Structure of PDB 7ci0 Chain A Binding Site BS03

Receptor Information
>7ci0 Chain A (length=309) Species: 1044 (Erythrobacter longus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TPFIRPDMKAFLEAIAAMAGPTLAEMTLEEARASYVALHGMADRPARELA
VIRNLSCPGPAGDIPLRLYDARESREAGPVITFYHGGGFVIGDLDTHHNL
CTEIAALMDLPVVAVDYRLAPEHPFPAAIEDCEAATRWVASSPSELGRTA
SGVIPIGDAAGGNATIVVSQLLGAKPADVPVVLQVPIFPLASDAVGSASL
EAFAEGFVLTKASIEFFDTAYKADRADPRGFPILGDHTAAPPTIVATASL
DPIRDSGRDYAKALVEAGRDVVYLEMEGVTHSFTNIRAAVPSTQGDLERI
IAAMKMMLG
Ligand information
Ligand IDNPO
InChIInChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H
InChIKeyBTJIUGUIPKRLHP-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341Oc1ccc(cc1)[N+]([O-])=O
ACDLabs 10.04O=[N+]([O-])c1ccc(O)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1[N+](=O)[O-])O
FormulaC6 H5 N O3
NameP-NITROPHENOL
ChEMBLCHEMBL14130
DrugBankDB04417
ZINCZINC000034828682
PDB chain7ci0 Chain A Residue 403 [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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PDB7ci0 Mechanism and Structural Insights Into a Novel Esterase, E53, Isolated From Erythrobacter longus .
Resolution1.7 Å
Binding residue
(original residue number in PDB)		V211 F220
Binding residue
(residue number reindexed from 1)		V208 F217
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity

View graph for
Molecular Function
External links
PDB RCSB:7ci0, PDBe:7ci0, PDBj:7ci0
PDBsum7ci0
PubMed35069500
UniProtA0A074MDU6

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