NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type subtype subsubtype other_prop
13145 1u6p cing 1-original 22 DYANA/DIANA distance hydrogen bond simple LOWER_ONLY=true



#-----------------------------------------------------------------
#   Hydrogen Bonds
#-----------------------------------------------------------------
#Tail
 21 LEU  N      18 ARG  O       2.70  1.00E+00
 21 LEU  HN     18 ARG  O       1.80  1.00E+00
 25 GLN  N      22 ASP- O       2.70  1.00E+00
 25 GLN  HN     22 ASP- O       1.80  1.00E+00
 33 GLY  N      24 ASP- O       2.70  1.00E+00
 33 GLY  HN     24 ASP- O       1.80  1.00E+00

 26 CYS- N      31 GLU- O       2.70  1.00E+00
 26 CYS- HN     31 GLU- O       1.80  1.00E+00
 30 LYS  N      26 CYS- O       2.70  1.00E+00
 30 LYS  HN     26 CYS- O       1.80  1.00E+00
 28 TYR  HN     26 CYS- SG      2.25  1.00E+00 
 28 TYR  N      26 CYS- SG      3.25  1.00E+00
 31 GLU- HN     29 CYS- SG      2.25  1.00E+00
 31 GLU- N      29 CYS- SG      3.25  1.00E+00
 29 CYS- HN     26 CYS- SG      2.25  1.00E+00
 29 CYS- N      26 CYS- SG      3.25  1.00E+00
 38 ASP- N      35 TRP  O       2.70  1.00E+00
 38 ASP- HN     35 TRP  O       1.80  1.00E+00
 39 CYSZ N      36 ALA  O       2.70  1.00E+00
 39 CYSZ HN     36 ALA  O       1.80  1.00E+00
 41 LYS  HN     39 CYSZ SG      2.25  1.00E+00
 41 LYS  N      39 CYSZ SG      3.25  1.00E+00
 42 LYS  HN     39 CYSZ O       1.80  1.00E+00
 42 LYS  N      39 CYSZ O       2.70  1.00E+00

#--------------------------------------------
# Unusual H-bonds

 23 ARG  O      35 TRP  HE1     1.90  1.00E+00
 23 ARG  O      35 TRP  NE1     2.90  1.00E+00

#----------- End NC Protein HBond Restraints

#-------------------------------------------------------
# Begin Intermolecular NC-Linker RNA H-bond Restraints
#-------------------------------------------------------

# GUA 309
 309 RGUA O6    27 ALA  HN        1.80  1.00E+00
 309 RGUA O6    27 ALA  N         2.70  1.00E+00
 309 RGUA O6    36 ALA  HN        1.80  1.00E+00
 309 RGUA O6    36 ALA  N         2.70  1.00E+00

 309 RGUA H1    25 GLN  O         1.80  1.00E+00
 309 RGUA N1    25 GLN  O         2.70  1.00E+00
 309 RGUA H21   25 GLN  O         1.80  1.00E+00
 309 RGUA N2    25 GLN  O         2.70  1.00E+00

 309 RGUA H21   22 ASP- O         1.80  1.00E+00
 309 RGUA H22   22 ASP- O         1.80  1.00E+00
 309 RGUA N2    22 ASP- O         2.00  1.00E+00

 309 RGUA O2'   23 ARG  HE        1.80  1.00E+00
 309 RGUA O2'   23 ARG  NE        2.70  1.00E+00

#309 RGUA OP2   37 LYS  HZ2       1.80  1.00E+00 #Questionable
#309 RGUA OP2   37 LYS  NZ        2.70  1.00E+00 #Questionable

 309 RGUA N7    37 LYS  HZ2       1.80  1.00E+00 #Questionable
 309 RGUA N7    37 LYS  NZ        2.70  1.00E+00 #Questionable

# URA 308
#308 URA  O4    30 LYS  HZ2       1.80  1.00E+00  #Questionable
#308 URA  O4    30 LYS  NZ        2.70  1.00E+00  #Questionable

 308 URA  O2'   18 ARG  HE        1.80  1.00E+00
 308 URA  O2'   18 ARG  NE        2.70  1.00E+00

# URA 307
 307 RCYT O2    42 LYS  HZ1       1.80  1.00E+00
 307 RCYT O2    42 LYS  NZ        2.70  1.00E+00
 307 RCYT N3    42 LYS  HZ3       1.80  1.00E+00
 307 RCYT N3    42 LYS  NZ        2.70  1.00E+00

# URA 306
#306 URA  O4    41 LYS  HZ1       1.80  1.00E+00  #Questionable
#306 URA  O4    41 LYS  NZ        2.70  1.00E+00  #Questionable

#306 URA  O2'   30 LYS  HZ3       1.80  1.00E+00  #Questionable
#306 URA  O2'   30 LYS  NZ        2.70  1.00E+00  #Questionable

#################################################################
######  END NC-Linker Restraints
#################################################################
####################################################################
#### Begin slBm 
####################################################################
#--------------------------------------------------------------------
#
# SLB mutant RNA- lower limit file for H-bonds
# Created by dhabib2 1/29/02 modified by adey1 10/7/02
# Indicate modifications with a comment on the same line as the change
# 
#--------------------------------------------------------------------

#----------------------BEGIN H-BONDS---------------------------------
#G276-A305
 276 RGUA H1   305 RADE N1      1.80  1.00E+00
 276 RGUA N1   305 RADE N1      2.90  1.00E+00
 276 RGUA O6   305 RADE H61     1.80  1.00E+00
 276 RGUA O6   305 RADE N6      2.90  1.00E+00

 #G277-U304
 277 RGUA H1   304 URA  O2      1.80  1.00E+00
 277 RGUA N1   304 URA  O2      2.90  1.00E+00
 277 RGUA O6   304 URA  H3      1.80  1.00E+00
 277 RGUA O6   304 URA  N3      2.90  1.00E+00

#C278-G303
 278 RCYT N3   303 RGUA H1      1.80  1.00E+00
 278 RCYT N3   303 RGUA N1      2.90  1.00E+00
 278 RCYT O2   303 RGUA H21     1.80  1.00E+00
 278 RCYT O2   303 RGUA N2      2.90  1.00E+00
 278 RCYT H41  303 RGUA O6      1.80  1.00E+00
 278 RCYT N4   303 RGUA O6      2.90  1.00E+00

#G279-U302 Wobble ---  Per Doug Turner
 279 RGUA O6   302 URA H3            1.80  1.00E+00
 279 RGUA O6   302 URA N3            2.90  1.00E+00
 279 RGUA H1   302 URA O2            1.80  1.00E+00
 279 RGUA N1   302 URA O2            2.90  1.00E+00

#G280-C301
 280 RGUA H1   301 RCYT N3      1.80  1.00E+00
 280 RGUA N1   301 RCYT N3      2.90  1.00E+00
 280 RGUA H21  301 RCYT O2      1.80  1.00E+00
 280 RGUA N2   301 RCYT O2      2.90  1.00E+00
 280 RGUA O6   301 RCYT H41     1.80  1.00E+00
 280 RGUA O6   301 RCYT N4      2.90  1.00E+00

#U281-U300  Wobble
 281 URA  O2   300 URA  H3      1.80  1.00E+00
 281 URA  O2   300 URA  N3      2.90  1.00E+00
#281 URA  H3   300 URA  O4      1.80  1.00E+00
#281 URA  N3   300 URA  O4      2.90  1.00E+00

#A282-C299 Wobble
 282 RAD+ H61  299 RCYT N3      1.80  1.00E+00
 282 RAD+ N6   299 RCYT N3      2.90  1.00E+00
 282 RAD+ N1   299 RCYT O2      2.90  1.00E+00
 282 RAD+ H1   299 RCYT O2      1.80  1.00E+00

#C283-G298
 283 RCYT N3   298 RGUA H1      1.80  1.00E+00
 283 RCYT N3   298 RGUA N1      2.90  1.00E+00
 283 RCYT O2   298 RGUA H21     1.80  1.00E+00
 283 RCYT O2   298 RGUA N2      2.90  1.00E+00
 283 RCYT H41  298 RGUA O6      1.80  1.00E+00
 283 RCYT N4   298 RGUA O6      2.90  1.00E+00

#U284-A297
 284 URA  H3   297 RADE N1      1.80  1.00E+00
 284 URA  N3   297 RADE N1      2.90  1.00E+00
 284 URA  O4   297 RADE H61     1.80  1.00E+00
 284 URA  O4   297 RADE N6      2.90  1.00E+00

#A285-U296
 285 RADE  N1  296 URA H3      1.80  1.00E+00
 285 RADE  N1  296 URA N3      2.90  1.00E+00
 285 RADE  H61 296 URA O4      1.80  1.00E+00
 285 RADE  N6  296 URA O4      2.90  1.00E+00

#G286-C295
 286 RGUA H1   295 RCYT N3      1.80  1.00E+00
 286 RGUA N1   295 RCYT N3      2.90  1.00E+00
 286 RGUA H21  295 RCYT O2      1.80  1.00E+00
 286 RGUA N2   295 RCYT O2      2.90  1.00E+00
 286 RGUA O6   295 RCYT H41     1.80  1.00E+00
 286 RGUA O6   295 RCYT N4      2.90  1.00E+00

#U287-A294
 287 URA  H3   294 RADE N1      1.80  1.00E+00
 287 URA  N3   294 RADE N1      2.90  1.00E+00
 287 URA  O4   294 RADE H61     1.80  1.00E+00
 287 URA  O4   294 RADE N6      2.90  1.00E+00

#U288-A293
 288 URA  H3   293 RADE N1      1.80  1.00E+00
 288 URA  N3   293 RADE N1      2.90  1.00E+00
 288 URA  O4   293 RADE H61     1.80  1.00E+00
 288 URA  O4   293 RADE N6      2.90  1.00E+00

#----------------------------------------------------------------------
#  GNRA loop H-bonds
#  All H-bond information from Art Pardi's lab 
#  Jucker et al., (1996) 264, 968-980

#G289-A292
 289 RGUA H22   292 RADE N7       1.80  1.00E+00
 289 RGUA N2    292 RADE N7       2.90  1.00E+00
#289 RGUA O2'    292 RADE H61     1.89  1.00E+00
#289 RGUA O2'    292 RADE N6      3.00  1.00E+00
 289 RGUA HO2'   291 RGUA N7      1.80  1.00E+00
#289 RGUA O2'    291 RGUA O6      3.00  1.00E+00 NOT LINEAR H-BOND


#----------------------------------------------------------------------
# End slBm H-bond restraints
#----------------------------------------------------------------------


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