Structure of PDB 3hq9 Chain A Binding Site BS04
Receptor Information
>3hq9 Chain A (length=312) Species:
35554
(Geobacter sulfurreducens) [
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ADELQQRAQGLFKPVPAKAPTLKGNPASPVKVELGKMLYFDPRLSASHLI
SCNTCHNVGLGGGDLQATSTGHGWQKGPRNAPTVLNSVFNTAQFWDGRAK
DLAEQAKGPVQAPVEMNNTPDQVVKTLNSIPDYVALFKKAFPGEKDPVTF
DNMAKAIEVFEATLITPDSPFDQYLKGKKKALDGKQTAGLKLFLDKGCVA
CHGGLNLGGTGYFPFGVVEGRFAVTNTAKDEYVFRAPSLRNVAITYPYFH
SGVVWSLKEAVAVMGSAQFGIKLSDDESEAIAAFLGSLTGKQPKVVYPIM
PASTDATPRPRL
Ligand information
Ligand ID
OXL
InChI
InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)/p-2
InChIKey
MUBZPKHOEPUJKR-UHFFFAOYSA-L
SMILES
Software
SMILES
ACDLabs 10.04
CACTVS 3.341
[O-]C(=O)C([O-])=O
OpenEye OEToolkits 1.5.0
C(=O)(C(=O)[O-])[O-]
Formula
C2 O4
Name
OXALATE ION
ChEMBL
DrugBank
ZINC
PDB chain
3hq9 Chain A Residue 348 [
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Receptor-Ligand Complex Structure
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PDB
3hq9
CcpA from Geobacter sulfurreducens is a basic di-heme cytochrome c peroxidase.
Resolution
1.52 Å
Binding residue
(original residue number in PDB)
Q132 A133
Binding residue
(residue number reindexed from 1)
Q111 A112
Annotation score
1
Enzymatic activity
Catalytic site (original residue number in PDB)
E136
Catalytic site (residue number reindexed from 1)
E115
Enzyme Commision number
1.11.1.5
: cytochrome-c peroxidase.
Gene Ontology
Molecular Function
GO:0009055
electron transfer activity
GO:0016491
oxidoreductase activity
GO:0020037
heme binding
View graph for
Molecular Function
External links
PDB
RCSB:3hq9
,
PDBe:3hq9
,
PDBj:3hq9
PDBsum
3hq9
PubMed
19735665
UniProt
Q749D0
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