NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
11027 |
1qrj   |
4311 | cing | 1-original | 15 | DYANA/DIANA | distance | NOE | simple |
#------------ Main Chain ---------------------------- 165 LYS+ HA 165 LYS+ HN 5.0 # 165 LYS+ HA 166 ASP- HN 5.0 # 165 LYS+ HN 166 ASP- HN 2.9 # #165 LYS+ HN 168 ILE HN 5.0 # not present 165 LYS+ HA 168 ILE HN 5.0 # #165 LYS+ HA 168 ILE HB 3.3 # not present 165 LYS+ HA 169 LEU HN 5.0 # #------------ Side Chain ---------------------------- 165 LYS+ HA 168 ILE QD1 5.00 1.00E+00# 165 LYS+ HA 168 ILE QG2 5.50 1.00E+00 165 LYS+ HN 166 ASP- QB 5.00 1.00E+00 165 LYS+ QB 168 ILE QD1 5.50 1.00E+00 165 LYS+ QD 169 LEU QD1 5.00 # 165 LYS+ QD 169 LEU QD2 3.30 # 165 LYS+ QE 169 LEU QD2 3.30 # 165 LYS+ QG 169 LEU QD1 5.00 #over 165 LYS+ QG 169 LEU QD2 5.00 #over #------------ Main Chain ---------------------------- 166 ASP- HA 166 ASP- HN 5.0 # #166 ASP- HN 167 PRO HN 2.9 # #166 ASP- HA 167 PRO HN 5.0 # 166 ASP- HN 168 ILE HN 5.0 # 166 ASP- HN 169 LEU HN 5.0 # not present 166 ASP- HA 169 LEU HB2 5.00 # 166 ASP- HA 169 LEU HN 5.0 # 166 ASP- HA 170 ARG+ HN 5.5 #sd #------------ Side Chain ---------------------------- #166 ASP- HN 168 ILE QD1 5.5 #3d,sd #166 ASP- HA 169 LEU QD1 5.50 #sd 166 ASP- HA 169 LEU QD2 5.00 # #~~~~~~~~~~~~~~PRO167is trans~~~~~~~~~~~~~~~~~~~~~ #But uncommon: NH-Hd2/3 instead of Ha-Hd2/3 (helical) 166 ASP- HN 167 PRO HD2 3.30 1.00E+00#3d 166 ASP- HN 167 PRO HD3 3.30 1.00E+00#3d 166 ASP- QB 167 PRO HD2 5.00 1.00E+00 166 ASP- QB 167 PRO HD3 5.50 1.00E+00 #------------ Main Chain ---------------------------- 167 PRO HA 168 ILE HN 5.5 # 167 PRO HD2 168 ILE HN 5.5 #sd 167 PRO HD3 168 ILE HN 5.5 #sd 167 PRO QG 168 ILE HN 3.3 #3d #167 PRO HA 170 ARG+ HN 5.0 # not present #167 PRO HA 170 ARG+ HB 3.3 # not present #167 PRO HA 171 SER HN 5.0 # not present #------------ Side Chain ---------------------------- #------------ Main Chain ---------------------------- 168 ILE HA 168 ILE HN 3.3 # #168 ILE HA 169 LEU HN 5.5 # 168 ILE HN 169 LEU HN 2.9 # 168 ILE HN 170 ARG+ HN 5.0 # 168 ILE HN 171 SER HN 5.0 # 168 ILE HA 171 SER HN 5.0 # 168 ILE HA 171 SER QB 3.3 # 168 ILE HA 172 LEU HN 5.0 #3d #------------ Side Chain ---------------------------- 168 ILE QG2 171 SER QB 5.00 1.00E+00 168 ILE QG2 172 LEU QD1 3.3 #< 168 ILE QG2 172 LEU QD2 5.0 #sd> 168 ILE QD1 172 LEU QD1 5.5 # 168 ILE QD1 172 LEU QD2 5.5 # #------------ Main Chain ---------------------------- 169 LEU HA 169 LEU HN 5.0 # 169 LEU HA 169 LEU QD1 3.30 #< 169 LEU HA 169 LEU QD2 5.00 #> 169 LEU HN 170 ARG+ HN 2.9 # 169 LEU HA 170 ARG+ HN 5.0 # 169 LEU HN 171 SER HN 5.0 # 169 LEU HN 172 LEU HN 5.0 # vw #169 LEU HA 172 LEU HN 5.0 # not present #169 LEU HA 172 LEU HB 3.3 # not present 169 LEU HA 173 ALA HN 5.0 # #------------ Side Chain QD1=0.79/23.8;QD2=0.87/26.7 (ssAI)---------------- 169 LEU HG 173 ALA QB 5.00 #ov 169 LEU QD1 173 ALA QB 5.50 #sd #169 LEU QD2 173 ALA QB 5.50 #sd #------------ Main Chain ---------------------------- 170 ARG+ HA 170 ARG+ HN 5.0 # 170 ARG+ HA 171 SER HN 5.0 # 170 ARG+ HN 171 SER HN 2.9 # 170 ARG+ HN 172 LEU HN 5.0 # 170 ARG+ HN 173 ALA HN 5.0 # 170 ARG+ HA 173 ALA HN 5.0 # 170 ARG+ HA 173 ALA QB 5.0 #sd #170 ARG+ HA 174 TYR HN 5.0 # not present #------------ Side Chain ---------------------------- 170 ARG+ HD2 195 LEU HN 5.5 #3d 170 ARG+ HD3 195 LEU HN 5.5 #3d 170 ARG+ HD2 195 LEU HA 5.5 #3d #------------ Main Chain ---------------------------- 171 SER HA 171 SER HN 3.3 # 171 SER HA 172 LEU HN 5.0 # 171 SER HN 172 LEU HN 2.9 # 171 SER HN 173 ALA HN 5.5 # 171 SER HN 174 TYR HN 5.0 # #171 SER HA 174 TYR HN 5.0 # not present #171 SER HA 174 TYR HB 3.3 # not present #171 SER HA 175 SER HN 5.0 # not present #------------ Side Chain ---------------------------- #------------ Main Chain ---------------------------- 172 LEU HA 172 LEU HN 5.0 # #172 LEU HN 172 LEU QD1 5.0 # #172 LEU HN 172 LEU QD2 5.0 # #172 LEU HA 172 LEU QD1 5.5 #> 172 LEU HA 172 LEU QD2 3.3 #< 172 LEU HA 173 ALA HN 5.5 # 172 LEU HN 173 ALA HN 2.9 # 172 LEU HN 174 TYR HN 5.0 # 172 LEU HN 175 SER HN 5.5 # vw 172 LEU HA 175 SER HN 5.5 # vw 172 LEU HA 175 SER QB 5.0 # W #------ Side Chain -(ssINP=>qd1=1.00/27.66;qd2=1.03/22.49)-- 172 LEU HA 176 ASN HN 5.50 1.00E+00 #------------ Main Chain ---------------------------- 173 ALA HA 173 ALA HN 5.0 # 173 ALA HA 174 TYR HN 5.5 # 173 ALA HN 174 TYR HN 2.9 # 173 ALA HN 175 SER HN 5.0 #3.3to5.0 #------------ Side Chain ---------------------------- #------------ Main Chain ---------------------------- 174 TYR HA 174 TYR HN 5.5 # 174 TYR HA 175 SER HN 5.5 # 174 TYR HN 175 SER HN 2.9 # 174 TYR HN 176 ASN HN 3.8 #sd 174 TYR HA 176 ASN HN 5.50 # 1.00E+00 174 TYR HN 177 ALA HN 5.50 1.00E+00 174 TYR HA 177 ALA HN 5.50 1.00E+00 #------------ Side Chain ---------------------------- 174 TYR HA 177 ALA QB 5.00 1.00E+00 174 TYR HE1 177 ALA HN 5.50 #3d 174 TYR HD1 175 SER HA 5.00 1.00E+00 174 TYR HE1 175 SER HA 5.50 1.00E+00 #------------ Main Chain ---------------------------- #NH175 very weak 175 SER HA 175 SER HN 5.5 # vw cnnoe plane 175 SER HA 176 ASN HN 5.50 # only3d 175 SER HA 177 ALA HN 5.50 # only3d 175 SER HN 176 ASN HN 3.30 1.00E+00 ################################################ #~~~~~~~~~~~~~LOOP-VI (176-178)~~~~~~~~~~~ ################################################ 176 ASN HA 176 ASN HN 5.0 # 176 ASN HA 177 ALA HN 2.9 # 176 ASN HN 177 ALA HN 3.80 1.00E+00 177 ALA HA 177 ALA HN 5.0 # #177 ALA HN 178 ASN HN #absent 177 ALA HA 178 ASN HN 2.9 # #177 ALA HA 179 LYS+ HN 5.0 #3d,sd 177 ALA QB 181 CYS HA 5.50 1.00E+00 177 ALA QB 181 CYS HB2 5.00 1.00E+00 177 ALA QB 181 CYS HB3 5.00 1.00E+00 177 ALA QB 181 CYS HN 5.00 1.00E+00 # sk:7/9 177 ALA QB 182 GLN HA 5.50 1.00E+00 # 177 ALA QB 182 GLN QG 5.00 1.00E+00 # 177 ALA QB 182 GLN HN 3.30 1.00E+00 178 ASN HA 178 ASN HN 5.0 # 178 ASN HA 179 LYS+ HN 2.9 # 178 ASN HN 179 LYS+ HN 5.50 1.00E+00 178 ASN HA 179 LYS+ QB 5.50 1.00E+00 178 ASN HN 181 CYS HB2 5.00 1.00E+00#<
Contact the webmaster for help, if required. Friday, May 3, 2024 7:56:52 PM GMT (wattos1)