NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
12058 1sh1 1049 cing 1-original 3 DYANA/DIANA distance NOE simple


 1 ALA                                                                          
        HA       2 ALA  HN      2.5    #89 S    S    SEQ                        
 2 ALA                                                                          
        HN       3 CYS  HN      4.5    #38 W    S    SEQ                        
        HA       3 CYS  HN      3.1    #53 M    S    SEQ                        
        MB      17 LEU  QPB     7.4    #463 W   L    LR                         
        MB      17 LEU  QQD     8.7    #465 W   L    LR                         
        HA      20 THR  HA      3.0    #329B S  L    LR                         
        HA      20 THR  MG      6.9    #427 W-1 L    LR                         
        HA      21 VAL  MG2     6.9    #392 W-1 L    LR                         
 3 CYS                                                                          
        QPB      4 LYS  HN      4.0    #254A M  S    SEQ                        
        HN      17 LEU  QQD     8.5  #416  W-2  L  LR                           
        HN      19 GLY  HN      5.5    #28 W     L    LR                        
        HN      21 VAL  MG2     6.9    #298 W-1  L    LR                        
        HB1     21 VAL  MG2     4.6    #   377  M   L    LR                     
        HB2     21 VAL  MG2     4.6    #  226 M    L    LR                      
        QPB     37 TYR  CZ4     6.6    #260A M   L   LR                         
 4 LYS                                                                          
        HA       5 CYS  HN      3.1    #163 M    S    SEQ                       
        HA      17 LEU  HA      3.6  #336 M L LR                                
        HN      17 LEU  QQD     7.7    #290 W   L    LR                         
        HA      17 LEU  QQD     5.8    #388 M   L    LR                         
        HA      19 GLY  HN      5.5  #170 W L LR                                
        HN      21 VAL  MG2     7.3    #307 W-2 L    LR                         
 5 CYS                                                                          
        HN       5 CYS  QPB     3.7    #252A M    S    I                        
        HA       6 ASP  HN      3.1    #133 M    S    SEQ                       
        QPB      7 ASP  HN      6.4    #189 W    L    LR                        
        HB1      8 GLU  QPG     6.4    # 362 W    L    LR                       
        HB2      8 GLU  QPG     6.4    # 361 W    L    LR                       
        HN       8 GLU  QPG     6.4    #314 W    L    LR                        
        HN      17 LEU  HA      5.5    #122 W    L    LR                        
        HN      17 LEU  QQD     8.5    #286 W-2 L    LR                         
        HN      18 THR  HN      5.5    #7 W    L    LR                          
        HA      34 ALA  MB      6.5    #464 W  L    LR                          
 6 ASP                                                                          
        HN       6 ASP  QPB     3.7    #247A M    S    I                        
        HN       7 ASP  HN      3.1    #4 M     S    SEQ                        
        HB1      7 ASP  HN      4.5    # 249B W  S    SEQ                       
        HB2      7 ASP  HN      4.5    # 249A W  S    SEQ                       
        QPB     34 ALA  HA      6.4    #354  W  L    LR                         
 7 ASP                                                                          
        HN       7 ASP  HB1     3.1    #  224  M  S  I                          
        HN       7 ASP  HB2     3.1    #  213 M    S    I                       
        HN       8 GLU  HN      3.1    #30 M    S    SEQ                        
 8 GLU                                                                          
        HN       8 GLU  QPB     3.7    #527 M    S    I                         
        HN       8 GLU  QPG     4.5    #313 M   L     I                         
        HN       9 GLY  HN      3.1    #13 M    S    SEQ                        
        HA       9 GLY  HN      3.1    #119 M    S    SEQ                       
        CB      16 PRO  HD1     8.1    #   358,359  W-1  L  LR                  
        CG      16 PRO  HD1     8.1    #   358,359  W-1  L  LR                  
        CB      16 PRO  HD2     8.1    #   358,359 W-1  L  LR                   
        CG      16 PRO  HD2     8.1    #   358,359 W-1  L  LR                   
        QPG     18 THR  MG      7.8    #492 W-1  L   LR                         
 9 GLY                                                                          
        HN      10 PRO  QPD     5.4    #76 W    S    SEQ                        
        QPA     10 PRO  QPD     4.8    #108 M    S    SEQ                       
10 PRO                                                                          
        HD1     11 ASP  HN      4.5    #  72,75  W  S  SEQ                      
        HD2     11 ASP  HN      4.5    #  72,75 W S    SEQ                      
        HA      11 ASP  HN      3.1    #165 M    S    SEQ                       
11 ASP                                                                          
        HN      11 ASP  HB1     3.1    #  219,268  M  S  I                      
        HN      11 ASP  HB2     3.1    #  268,219 M    S    I                   
        HN      12 ILE  HN      4.5    #172   W  S  SEQ                         
12 ILE                                                                          
        HA      13 ARG  HN      3.1    #85 M    S    SEQ                        
        MG      13 ARG  HA      6.5    #437 W   L    SEQ                        
        HA      15 ALA  HN      5.5    #86 W    L    LR                         
13 ARG                                                                          
        HN      14 THR  HN      3.1    #10 M    S    SEQ                        
        HA      14 THR  HN      3.1    #83 M    S    SEQ                        
14 THR                                                                          
15 ALA                                                                          
        HA      16 PRO  HD1     3.1    #  332,331 M  S  SEQ                     
        HA      16 PRO  HD2     3.1    #  332,331 M   S    SEQ                  
16 PRO                                                                          
        HD1     17 LEU  HN      4.5    # 176,87  W S SEQ                        
        HD2     17 LEU  HN      4.5    # 176,87 W S SEQ                         
17 LEU                                                                          
        HN      18 THR  HN      4.5    #8 W    S    SEQ                         
        HA      18 THR  HN      3.1    #115 M    S    SEQ                       
        HB1     18 THR  HN      4.5    #315 W S SEQ                             
        HB2     18 THR  HN      4.5    #433 W S SEQ                             
        HA      19 GLY  HN      5.5    #123 W    L    LR                        
18 THR                                                                          
        HN      19 GLY  HN      3.1    #1 M    S    SEQ                         
        HB      45 ARG  HD1     5.5    # 186,185  W  L  LR                      
        HB      45 ARG  HD2     5.5    # 186,185 W  L   LR                      
19 GLY                                                                          
        HN      20 THR  HN      4.5    #174 W    S    SEQ                       
        QPA     45 ARG  HA      6.3    #339 W   L    LR                         
20 THR                                                                          
        HB      21 VAL  HN      4.5    #73 W    S    SEQ                        
        HN      30 TRP  CZ5     7.9    #33 W    L    LR                         
        HN      30 TRP  CH6     7.9    #33 W    L    LR                         
        HB      30 TRP  HE4     5.5    #81 W      L    LR                       
        HB      30 TRP  CZ5     5.4    #79 S    L    LR                         
        HB      30 TRP  CH6     5.4    #79 S    L    LR                         
        MG      30 TRP  CZ5     8.9    #430 W   L    LR                         
        MG      30 TRP  CH6     8.9    #430 W   L    LR                         
        HN      44 CYS  HN      5.5    #2  W    L    LR                         
        HB      44 CYS  HN      5.5    #68 W    L    LR                         
21 VAL                                                                          
        HN      21 VAL  MG2     4.6    #297 M   L    I                          
        HN      21 VAL  HB      3.1    #532 M   S    I                          
        HA      22 ASP  HN      2.5    #100 S   S    SEQ                        
        MG1     22 ASP  HA      6.5    #393 W   L   SEQ                         
        MG1     37 TYR  CG1     8.6    #300 W   L    LR                         
        MG2     37 TYR  CG1     9.0    #301 W-1  L  LR                          
        MG1     37 TYR  CZ4     6.7    #303 M   L    LR                         
        MG2     37 TYR  CZ4     8.6    #304 W   L    LR                         
        MG1     41 ALA  MB      5.6    #475 M   L    LR                         
        MG2     41 ALA  MB      7.9    #476 W-1 L    LR                         
        HA      43 CYS  HA      3.6    #333 M   L    LR                         
        HA      44 CYS  HN      5.5    #102 W    L    LR                        
22 ASP                                                                          
        HN      41 ALA  MB      6.9    #504 W-1  L   LR                         
        HN      42 ASP  HN      5.5    #43 W    L    LR                         
23 LEU                                                                          
        HA      24 GLY  HN      2.5    #95 S    S    SEQ                        
        HA      41 ALA  HA      3.6    #330  M   L   LR                         
        HA      41 ALA  MB      4.6    #495 M   L    LR                         
24 GLY                                                                          
        HN      25 SER  HN      4.5    #42 W    S    SEQ                        
25 SER                                                                          
        HA      26 CYS  HN      3.1    #138 M   S    SEQ                        
        QPB     26 CYS  HN      4.0    #97 M    S    SEQ                        
        HA      42 ASP  QPB     6.4    #348 W   L    LR                         
26 CYS                                                                          
        QPB     30 TRP  QPB     7.3  #228  W L LR                               
        QPB     44 CYS  HA      6.4    #329 W   L    LR                         
27 ASN                                                                          
        HN      27 ASN  HB1     3.1    #  520 M    S    I                       
        HN      27 ASN  HB2     3.1    #  238  M  S  I                          
        HA      28 ALA  HN      2.5    #162 S    S    SEQ                       
        QPB     28 ALA  HN      4.0    #237 M    S    SEQ                       
        HN      30 TRP  QPB     6.4    #77 W    L    LR                         
        QPB     30 TRP  HD2     4.5    #521 M    L    LR                        
        HB1     30 TRP  HE1     5.5    #  250A,524  W    L  LR                  
        HB2     30 TRP  HE1     5.5    #  524,250A W   L    LR                  
28 ALA                                                                          
        HA      29 GLY  HN      2.5    #130 S    S    SEQ                       
        HA      30 TRP  HN      5.5    #132 W    L    LR                        
29 GLY                                                                          
        HN      30 TRP  HN      3.1    #3 M    S    SEQ                         
        QPA     30 TRP  HD2     4.5    #167 M L SEQ                             
30 TRP                                                                          
        HN      30 TRP  HB1     3.1    # 70,270  M S I                          
        HN      30 TRP  HB2     3.1    # 270,70 M S I                           
        HN      30 TRP  HD2     3.6    #27 M    L    I                          
        HB1     30 TRP  HD2     4.5    #  78,272  W  S  I                       
        HB2     30 TRP  HD2     4.5    #  78,272 W  S  I                        
        QPB     30 TRP  HE4     4.5    #271 M    L   I                          
        QPB     31 GLU  HN      4.0    #269 M    S   SEQ                        
        HE4     31 GLU  HN      5.5    #35 W      L  SEQ                        
        HE4     44 CYS  HA      5.9    #327 W-1   L  LR                         
        QPB     45 ARG  HN      6.4    #81B W L LR                              
        HE4     45 ARG  HN      5.5    #34 W      L  LR                         
        HE4     45 ARG  HA      3.6    #51 M    L    LR                         
        CZ5     45 ARG  HN      7.9    #32 W    L    LR                         
        CH6     45 ARG  HN      7.9    #32 W    L    LR                         
        CZ5     45 ARG  HA      6.0    #50 M    L    LR                         
        CH6     45 ARG  HA      6.0    #50 M    L    LR                         
        HE4     46 LYS  HN      5.5    #11 W      L    LR                       
        CZ5     46 LYS  HN      7.9    #12 W    L    LR                         
        CH6     46 LYS  HN      7.9    #12 W    L    LR                         
        HA      46 LYS  HA      3.0    #206 S    L    LR                        
        HE4     46 LYS  HA      5.5    #208 W   L    LR                         
        HD2     46 LYS  HA      5.5    #209 W   L    LR                         
        CZ5     46 LYS  QPB     8.8    #305B W   L   LR                         
        CH6     46 LYS  QPB     8.8    #305B W   L   LR                         
        HE1     46 LYS  HG1     5.9    # 308,306  W-1 L    LR                   
        HE1     46 LYS  HG2     5.9    # 306,308 W-1 L LR                       
        HE1     46 LYS  QPD     7.6    #501  W-3 L    LR                        
        HE1     46 LYS  QPE     6.8    #255A W-1 L    LR                        
        HZ7     46 LYS  QPE     6.4    #256A W   L    LR                        
        HZ7     46 LYS  QPD     6.4    #511  W   L    LR                        
        HA      47 LYS  HN      5.5    #63 W      L    LR                       
31 GLU                                                                          
        HN      31 GLU  QPG     4.5    #319 M    L    I                         
        HA      32 LYS  HN      3.1  #61  M S SEQ                               
        HN      44 CYS  HA      5.5    #47 W    L    LR                         
        HN      45 ARG  HN      3.6    #5  M    L    LR                         
        QPG     45 ARG  HN      6.4    #402 W L LR                              
        HN      46 LYS  HA      5.5    #204 W    L    LR                        
        HN      47 LYS  HN      5.5    #41 W      L    LR                       
        HN      47 LYS  HG1     5.9    # 503,503B  W-1 L LR                     
        HN      47 LYS  HG2     5.9    # 503B,503 W-1   L    LR                 
32 LYS                                                                          
        HN      32 LYS  HB1     3.1    # 516,533  M S I                         
        HN      32 LYS  HB2     3.1    # 533,516 M    S    I                    
        HA      33 CYS  HN      2.5    #110 S    S    SEQ                       
        QPB     34 ALA  HN      6.4    #517 W    L    LR                        
        HA      34 ALA  HN      5.5    #113 W    L    LR                        
        QPE     35 SER  HA      6.4    #203  W  L  LR                           
        HA      42 ASP  QPB     6.4    #217 W    L    LR                        
        HA      44 CYS  HA      3.0    #114 S  L    LR                          
        HB1     44 CYS  HA      5.5    # 456,455 W    L    LR                   
        HB2     44 CYS  HA      5.5    # 455,456  W  L  LR                      
        HG1     44 CYS  HA      5.9    # 457,458 W-1  L  LR                     
        HG2     44 CYS  HA      5.9    # 458,457 W-1  L    LR                   
        HA      45 ARG  HN      5.5    #111 W    L    LR                        
33 CYS                                                                          
        HN      34 ALA  HN      3.1    #31 M    S    SEQ                        
        HN      44 CYS  HA      3.6    #44 M    L    LR                         
        QPB     44 CYS  HA      6.8  #328 W-1 L LR                              
        QPB     45 ARG  HN      6.4    #197 W    L    LR                        
34 ALA                                                                          
        MB      43 CYS  QPB     7.4    #462 W     L   LR                        
        MB      36 TYR  HN      6.5    #469 W     L   LR                        
35 SER                                                                          
        HN      36 TYR  HN      3.1    #40 M    S    SEQ                        
        HA      36 TYR  HN      3.1    #96 M    S    SEQ                        
36 TYR                                                                          
        HN      36 TYR  QPB     3.7    #246 M    S    I                         
        CZ4     38 THR  HA      5.7  #324 M    L  LR                            
        CZ4     39 ILE  HA      7.6    #121 W   L    LR                         
37 TYR                                                                          
        HN      38 THR  HN      4.5    #29 W    S    SEQ                        
        HB1     38 THR  HN      3.1    #194,276 M S SEQ                         
        HB2     38 THR  HN      3.1    #194,276  M  S  SEQ                      
        CG1     38 THR  MG      8.6    #302 W   L   SEQ                         
        CZ4     38 THR  MG      8.6    #305 W   L    SEQ                        
        CG1     41 ALA  MB      6.7    #513 M   L    LR                         
        CZ4     41 ALA  MB      8.6    #514 W   L    LR                         
        CG1     42 ASP  HA      7.6    #59  W   L    LR                         
        HB1     43 CYS  HN      5.5    #198,275 W L LR                          
        HB2     43 CYS  HN      5.5    #275,198  W  L  LR                       
        QPB     43 CYS  QPB     7.3  #373 W L LR                                
        CG1     43 CYS  HN      8.0    #36 W-1    L    LR                       
        CG1     43 CYS  QPB     8.5    #318 W   L    LR                         
38 THR                                                                          
        HA      39 ILE  HN      3.1    #152 M    S    SEQ                       
        HB      39 ILE  HN      3.1    #151 M    S    SEQ                       
        HB      40 ILE  HN      5.5    #171 W L LR                              
        HN      41 ALA  MB      7.3    #508 W-2  L    LR                        
        HN      42 ASP  HA      5.5  #58 W L LR                                 
39 ILE                                                                          
        HN      39 ILE  HB      3.1    #528 M   S    I                          
        HN      40 ILE  HN      4.5    #9   W   S    SEQ                        
40 ILE                                                                          
        HN      40 ILE  HG1     3.6    # 512,440 M   L    I                     
        HN      40 ILE  HG2     3.6    # 440,512  M  L  I                       
        HN      41 ALA  HN      3.1    #14 M    S    SEQ                        
        HB      41 ALA  HN      4.5    #399 W   S    SEQ                        
41 ALA                                                                          
42 ASP                                                                          
        HA      43 CYS  HN      3.1    #56 M    S    SEQ                        
        HB1     43 CYS  HN      4.5    # 221,526  W  S  SEQ                     
        HB2     43 CYS  HN      4.5    # 221,526  W  S  SEQ                     
43 CYS                                                                          
44 CYS                                                                          
        HN      44 CYS  QPB     3.7    #274   M   S   I                         
        HA      45 ARG  HN      3.1    #45 M    S    SEQ                        
        HB1     45 ARG  HN      4.5    #  B255,273  W  S  SEQ                   
        HB2     45 ARG  HN      4.5    #  B255,273  W  S  SEQ                   
45 ARG                                                                          
        HA      46 LYS  HN      3.1    #49 M    S    SEQ                        
46 LYS                                                                          
        HN      46 LYS  HB1     3.1    # 450,293 M    S    I                    
        HN      46 LYS  HB2     3.1    # 293,450  M  S  I                       
        HA      47 LYS  HN      2.5    #205 S    S    SEQ                       
        HG1     47 LYS  HN      5.5    #  292,294  W  L  SEQ                    
        HG2     47 LYS  HN      5.5    #  292,294  W  L  SEQ                    
47 LYS                                                                          
        HN      48 LYS  HN      4.5    #173   W  S  SEQ                         
        HA      48 LYS  HN      2.5    #105 S    S    SEQ                       
        HB1     48 LYS  HN      4.5    #  454,506  W  S  SEQ                    
        HB2     48 LYS  HN      4.5    #  454,506  W  S  SEQ                    
48 LYS                                                                          



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Tuesday, May 14, 2024 6:41:53 AM GMT (wattos1)