Structure of PDB 2jig Chain A Binding Site BS03

Receptor Information
>2jig Chain A (length=216) Species: 3055 (Chlamydomonas reinhardtii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EEWRGEVVHLSWSPRAFLLKNFLSDEECDYIVEKARPKMVKSSVVDNESG
KSVDSEIRTSTGTWFAKGEDSVISKIEKRVAQVTMIPLENHEGLQVLHYH
DGQKYEPHYDYFHDPVNAGPEHGGQRVVTMLMYLTTVEEGGETVLPNAEQ
KVTGDGWSECAKRGLAVKPIKGDALMFYSLKPDGSNDPASLHGSCPTLKG
DKWSATKWIHVAPIGG
Ligand information
Ligand IDPD2
InChIInChI=1S/C7H5NO4/c9-6(10)4-1-2-8-5(3-4)7(11)12/h1-3H,(H,9,10)(H,11,12)
InChIKeyMJIVRKPEXXHNJT-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341OC(=O)c1ccnc(c1)C(O)=O
ACDLabs 10.04O=C(O)c1nccc(C(=O)O)c1
OpenEye OEToolkits 1.5.0c1cnc(cc1C(=O)O)C(=O)O
FormulaC7 H5 N O4
NamePYRIDINE-2,4-DICARBOXYLIC ACID
ChEMBLCHEMBL316034
DrugBank
ZINCZINC000000391915
PDB chain2jig Chain A Residue 1254 [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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PDB2jig The Active Site of an Algal Prolyl 4-Hydroxylase Has a Large Structural Plasticity.
Resolution1.85 Å
Binding residue
(original residue number in PDB)
Y134 H143 D145 L166 H227 G228 S229 K237 T241 W243
Binding residue
(residue number reindexed from 1)
Y99 H108 D110 L131 H192 G193 S194 K202 T206 W208
Annotation score1
Binding affinityMOAD: Ki=70uM
Gene Ontology
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UnboundLocalError
Python 3.6.8: /usr/bin/python3
Sun Nov 17 18:26:47 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 = '2jig', asym_id = 'A', bs = 'BS03', title = 'The Active Site of an Algal Prolyl 4-Hydroxylase Has a Large Structural Plasticity.'
 /var/www/html/BioLiP/pdb.cgi in display_interaction(pdbid='2jig', asym_id='A', bs='BS03', title='The Active Site of an Algal Prolyl 4-Hydroxylase Has a Large Structural Plasticity.')
   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 = '0005506,0016705,0031418', uniprot = '', pdbid = '2jig', asym_id = 'A'
 /var/www/html/BioLiP/pdb.cgi in display_go(go='0005506,0016705,0031418', uniprot='', pdbid='2jig', asym_id='A')
    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>