Structure of PDB 6zzt Chain C Binding Site BS01

Receptor Information
>6zzt Chain C (length=259) Species: 39367 (Salvia rosmarinus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RRLEGKVAIVTGGASGIGASTVRLFHDHGAKVVIADIQDDLGQTLADRLG
RNISYTHCDVTDEDQVRALVDAAVAKHGGVDIMFSNAGIVEGPNSIFDVD
KDELERLMGINLVGAFLAAKHAARVMVPAKKGCIIFTASACTEIAGIAGH
SYTASKYGIVGLMKSLAVELGSHGIRANCVSPFGVLTGIVPDDEASKLMF
EGIMSKVGNLKGKILTAEDVAVTVLYLASEEASYVSGVNLLVDGGYTVVN
PTFINVITA
Ligand information
Ligand IDNAD
InChIInChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
InChIKeyBAWFJGJZGIEFAR-NNYOXOHSSA-N
SMILES
SoftwareSMILES
CACTVS 3.341NC(=O)c1ccc[n+](c1)[C@@H]2O[C@H](CO[P]([O-])(=O)O[P@](O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O
OpenEye OEToolkits 1.5.0c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N
CACTVS 3.341NC(=O)c1ccc[n+](c1)[CH]2O[CH](CO[P]([O-])(=O)O[P](O)(=O)OC[CH]3O[CH]([CH](O)[CH]3O)n4cnc5c(N)ncnc45)[CH](O)[CH]2O
OpenEye OEToolkits 1.5.0c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[P@@](=O)([O-])O[P@@](=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N
FormulaC21 H27 N7 O14 P2
NameNICOTINAMIDE-ADENINE-DINUCLEOTIDE
ChEMBLCHEMBL1234613
DrugBankDB14128
ZINC
PDB chain6zzt Chain C Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6zzt A Structural View on the Stereospecificity of Plant Borneol-Type Dehydrogenases.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		G19 S22 I24 D43 I44 Q45 C65 D66 V67 N93 A94 G95 V97 T144 S146 Y159 K163 G191 V192 T194 G195 I196
Binding residue
(residue number reindexed from 1)		G12 S15 I17 D36 I37 Q38 C58 D59 V60 N86 A87 G88 V90 T137 S139 Y152 K156 G184 V185 T187 G188 I189
Annotation score4
Gene Ontology
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UnboundLocalError		Python 3.6.8: /usr/bin/python3
Sat Nov 16 12:02:47 2024

A problem occurred in a Python script. Here is the sequence of function calls leading up to the error, in the order they occurred.

 /var/www/html/BioLiP/pdb.cgi in <module>()
   1435     title=pdb2title(pdbid)
   1436     if bs.startswith("BS"):
=> 1437         pubmed,uniprot=display_interaction(pdbid,asym_id,bs,title)
   1438     else:
   1439         if lig3:
pubmed = '', uniprot = '', display_interaction = <function display_interaction>, pdbid = '6zzt', asym_id = 'C', bs = 'BS01', title = 'A Structural View on the Stereospecificity of Plant Borneol-Type Dehydrogenases.'
 /var/www/html/BioLiP/pdb.cgi in display_interaction(pdbid='6zzt', asym_id='C', bs='BS01', title='A Structural View on the Stereospecificity of Plant Borneol-Type Dehydrogenases.')
   1295         display_ec(ec,csaOrig,csaRenu)
   1296     if go:
=> 1297         display_go(go,uniprot,pdbid,asym_id)
   1298     return pubmed,uniprot
   1299 
global display_go = <function display_go>, go = '0016491', uniprot = '', pdbid = '6zzt', asym_id = 'C'
 /var/www/html/BioLiP/pdb.cgi in display_go(go='0016491', uniprot='', pdbid='6zzt', asym_id='C')
    480         '''.replace("$namespace_link",namespace_link
    481           ).replace("$namespace",namespace
=>  482           ).replace("$uniprot",u
    483         ))
    484         for l,(term,name) in enumerate(go2aspect[Aspect]):
u undefined

UnboundLocalError: local variable 'u' referenced before assignment
      args = ("local variable 'u' referenced before assignment",)
      with_traceback = <built-in method with_traceback of UnboundLocalError object>