Structure of PDB 3tbc Chain C Binding Site BS05
Receptor Information
>3tbc Chain C (length=277) Species:
67581
(Streptomyces viridosporus) [
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PAKTAPAGGEVKRIKLYAERLGGGQMGYGLEKGKATIPGPLIELNEGDTL
HIEFENTMDVPVSLHVHGLDYEISSDGTKQSRSDVEPGGTRTYTWRTHVP
GRRADGTWRAGSAGYWHYHDHVVGTEHGTGGIRNGLYGPVIVRRKGDVLP
DRTHTIVFNDMTINNRPAHTGPDFEATVGDRVEFVMITHGEYYHTFHLHG
HRWADNRTGMLTGPDDPSQVIDNKICGPADSFGFQVIAGEGVGAGAWMYH
CHVQSHSDMGMVGLFLVKKPDGTIPGY
Ligand information
Ligand ID
I75
InChI
InChI=1S/C9H10O3/c1-6(10)7-3-4-8(11)9(5-7)12-2/h3-5,11H,1-2H3
InChIKey
DFYRUELUNQRZTB-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.2
CC(=O)c1ccc(c(c1)OC)O
ACDLabs 12.01
O=C(c1cc(OC)c(O)cc1)C
CACTVS 3.370
COc1cc(ccc1O)C(C)=O
Formula
C9 H10 O3
Name
1-(4-hydroxy-3-methoxyphenyl)ethanone
ChEMBL
CHEMBL346919
DrugBank
DB12618
ZINC
ZINC000000162515
PDB chain
3tbc Chain C Residue 349 [
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Receptor-Ligand Complex Structure
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PDB
3tbc
Roles of small laccases from Streptomyces in lignin degradation.
Resolution
2.7 Å
Binding residue
(original residue number in PDB)
M193 T194
Binding residue
(residue number reindexed from 1)
M161 T162
Annotation score
1
Enzymatic activity
Enzyme Commision number
1.10.3.2
: laccase.
Gene Ontology
Molecular Function
GO:0005507
copper ion binding
GO:0016491
oxidoreductase activity
GO:0046872
metal ion binding
GO:0052716
hydroquinone:oxygen oxidoreductase activity
View graph for
Molecular Function
External links
PDB
RCSB:3tbc
,
PDBe:3tbc
,
PDBj:3tbc
PDBsum
3tbc
PubMed
24870309
UniProt
J9PBR2
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