Structure of PDB 1pwz Chain A Binding Site BS01

Receptor Information
>1pwz Chain A (length=252) Species: 358 (Agrobacterium tumefaciens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
STAIVTNVKHFGGMGSALRLSEAGHTVACHDESFKQKDELEAFAETYPQL
KPMSEQEPAELIEAVTSAYGQVDVLVSNDIFAPEFQPIDKYAVEDYRGAV
EALQIRPFALVNAVASQMKKRKSGHIIFITSATPFGPWKELSTYTSARAG
ACTLANALSKELGEYNIPVFAIGPNYLHSEDSPYFYPTEPWKTNPEHVAH
VKKVTALQRLGTQKELGELVAFLASGSCDYLTGQVFWLAGGFPMIERWPG
MP
Ligand information
Ligand IDCL
InChIInChI=1S/ClH/h1H/p-1
InChIKeyVEXZGXHMUGYJMC-UHFFFAOYSA-M
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Cl-]
FormulaCl
NameCHLORIDE ION
ChEMBL
DrugBankDB14547
ZINC
PDB chain1pwz Chain A Residue 255 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1pwz Structure and Mechanism of a Bacterial Haloalcohol Dehalogenase: a new variation of the short-chain dehydrogenase/reductase fold without an NAD(P)H binding site
Resolution2.5 Å
Binding residue
(original residue number in PDB)		N176 L178 Y187
Binding residue
(residue number reindexed from 1)		N175 L177 Y186
Annotation score3
Enzymatic activity
Enzyme Commision number ?
External links