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
13132 1u6p cing 1-original 9 DYANA/DIANA distance NOE simple


##---------------------------------------------------------
##  Intermolecular NOEs
##---------------------------------------------------------
###
# URA 306
# NOTE:  H5,H6, H2' exhibit large upfield shifts !!!
 306 URA  H1'     30 LYS  QE      5.80  1.00E+00
 306 URA  H2'     28 TYR  HA      5.00  1.00E+00  #was 3.3
 306 URA  H2'     28 TYR  QD      3.20  1.00E+00  #was 4.5
 306 URA  H2'     28 TYR  QE      3.20  1.00E+00  #was 4.5
 306 URA  H6      28 TYR  QE      5.10  1.00E+00
 306 URA  H5      28 TYR  QE      5.10  1.00E+00
 306 URA  H5      29 CYS- HA      5.00  1.00E+00
 306 URA  H5      29 CYS- QB      5.80  1.00E+00
 306 URA  H5      41 LYS  QE      5.90  1.00E+00
 306 URA  H5      41 LYS  QD      5.80  1.00E+00  #SD via QE

# RCYT 307
# NOTE:  H1',H5,H6 exhibit large downfield shifts!!!
 307 RCYT H1'     27 ALA  QB      5.50  1.00E+00
 307 RCYT H4'     27 ALA  QB      3.80  1.00E+00
 307 RCYT H1'     36 ALA  QB      3.80  1.00E+00
 307 RCYT H1'     28 TYR  QB      5.50  1.00E+00
 307 RCYT H1'     28 TYR  HA      5.00  1.00E+00
 307 RCYT H1'     28 TYR  QD      5.10  1.00E+00
 307 RCYT H6      28 TYR  HD1     2.70  1.00E+00
 307 RCYT H5      28 TYR  HE1     2.70  1.00E+00
 307 RCYT H1'     42 LYS  QE      5.80  1.00E+00

# URA 308
 308 URA  H6      27 ALA  QB      3.80  1.00E+00
 308 URA  H5      27 ALA  QB      3.80  1.00E+00
 308 URA  H6      21 LEU  QD1     3.30  1.00E+00
 308 URA  H5      21 LEU  QD1     3.30  1.00E+00
 308 URA  H5      30 LYS  QE      5.80  1.00E+00
 308 URA  H5      18 ARG  HA      5.00  1.00E+00
 308 URA  H5      18 ARG  QB      5.80  1.00E+00
 308 URA  H5      18 ARG  QG      5.80  1.00E+00
#308 URA  H6      18 ARG  HA      5.00  1.00E+00  #SD via H5


# RGUA 309
 309 RGUA H8      35 TRP  HZ3     5.00  1.00E+00
#309 RGUA H8      35 TRP  HH2     5.00  1.00E+00  #SD via HZ3
#309 RGUA H8      35 TRP  HE3     5.00  1.00E+00  #SD via HZ3
 309 RGUA H8      27 ALA  QB      6.50  1.00E+00
 309 RGUA H8      36 ALA  QB      6.50  1.00E+00
 309 RGUA H8      21 LEU  QD1     6.50  1.00E+00
 309 RGUA H1'     21 LEU  QD1     4.80  1.00E+00
 309 RGUA H8      37 LYS  QE      5.80  1.00E+00
#309 RGUA H8      37 LYS  QD      5.80  1.00E+00  #SD via QE
#309 RGUA H8      35 TRP  HZ2     5.00  1.00E+00  #SD via H2

#309 RGUA H1'     35 TRP  HZ2     5.00  1.00E+00  #SD via HZ3
 309 RGUA H2'     35 TRP  HZ3     5.00  1.00E+00
 309 RGUA H1'     35 TRP  HH2     5.00  1.00E+00
 309 RGUA H2'     35 TRP  HH2     5.00  1.00E+00

 309 RGUA H1'     23 ARG  QD      4.10  1.00E+00

 309 RGUA Q2      35 TRP  HE1     4.10  1.00E+00
 309 RGUA Q2      21 LEU  QD2     3.80  1.00E+00
 309 RGUA Q2      21 LEU  QB      6.30  1.00E+00
 309 RGUA Q2      23 ARG  HA      5.80  1.00E+00
 309 RGUA Q2      25 GLN  HN      4.10  1.00E+00
######################################################################
####### End NC-linker
######################################################################


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