Structure of PDB 7anv Chain A Binding Site BS01

Receptor Information
>7anv Chain A (length=467) Species: 1173061 (Geotrichum candidum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
APLDLNNIQGDILGGLPKKTETYFFFKITDAAAFRKHLKQLIPLITTTAQ
VQKDRKAIDEHLPLAGVNIAFSHAGLKKLGINDDNLGDTAFKAGQLADAQ
NLGDPGTGFVPDWDPAFKEKDIHGVILVAGDSHETVDKKLQEIEAIFGVG
GPHASIHEVLTIQGDVRPGDEKGHEHFGFQDGISQPAVKGFDTNPNPGQA
PVRPGVILVGRDGDSVARPSWAKDGSFLVFRKLQQLVPEFNKFLEENPIK
LPGNNLTPEEGSELLGARLVGRWKSGAPIDITPLQDDPELAKDPQRNNNF
RFDHPFADEQDSQTRCPFAAHIRKTNPRADLEDASPTSVESRRIIRRGIP
YGPEVTPEEKESKKTKHDRGLLFVCYQSNIENGFQFIQKSWANNPNFPPS
KPNPVTPGFDPIIGQAANNDGARTMSGTDPNNQANELSLPTELFVVPRGG
EYFFSPSISALKDTFAA
Ligand information
Ligand IDHEM
InChIInChI=1S/C34H34N4O4.Fe/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;
InChIKeyKABFMIBPWCXCRK-RGGAHWMASA-L
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6Cc1c2n3c(c1CCC(=O)O)C=C4C(=C(C5=[N]4[Fe]36[N]7=C(C=C8N6C(=C5)C(=C8C)C=C)C(=C(C7=C2)C)C=C)C)CCC(=O)O
CACTVS 3.385CC1=C(CCC(O)=O)C2=Cc3n4[Fe]5|6|N2=C1C=c7n5c(=CC8=N|6C(=Cc4c(C)c3CCC(O)=O)C(=C8C=C)C)c(C)c7C=C
ACDLabs 12.01C=1c3c(c(c4C=C5C(=C(C=6C=C7C(=C(C8=CC=2C(=C(C=1N=2[Fe](n34)(N5=6)N78)CCC(=O)O)C)\C=C)C)\C=C)C)C)CCC(=O)O
FormulaC34 H32 Fe N4 O4
NamePROTOPORPHYRIN IX CONTAINING FE;
HEME
ChEMBL
DrugBankDB18267
ZINC
PDB chain7anv Chain A Residue 601 [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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PDB7anv Mutational and structural analysis of an ancestral fungal dye-decolorizing peroxidase.
Resolution1.65 Å
Binding residue
(original residue number in PDB)		E216 Q221 I224 S225 Q279 H365 T369 N370 R390 L415 F417 F428 I456 I457
Binding residue
(residue number reindexed from 1)		E175 Q180 I183 S184 Q235 H321 T325 N326 R346 L371 F373 F384 I412 I413
Annotation score4
Gene Ontology
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UnboundLocalError		Python 3.6.8: /usr/bin/python3
Mon Nov 25 19:30:15 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 = '7anv', asym_id = 'A', bs = 'BS01', title = 'Mutational and structural analysis of an ancestral fungal dye-decolorizing peroxidase.'
 /var/www/html/BioLiP/pdb.cgi in display_interaction(pdbid='7anv', asym_id='A', bs='BS01', title='Mutational and structural analysis of an ancestral fungal dye-decolorizing peroxidase.')
   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 = '0004601,0020037', uniprot = '', pdbid = '7anv', asym_id = 'A'
 /var/www/html/BioLiP/pdb.cgi in display_go(go='0004601,0020037', uniprot='', pdbid='7anv', 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>