Structure of PDB 5k0w Chain B Binding Site BS01

Receptor Information
>5k0w Chain B (length=271) Species: 238 (Elizabethkingia meningoseptica) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VVKEPENMPKEWNQAYEPFRIAGNLYYVGTYDLASYLIVTDKGNILINTG
TAESFPIIKANIQKLGFNYKDIKILLLTQAHYDHTGALQDFKTETAAKFY
VDKADVDVLRTGGKSDYEMGKYGVTFKPVTPDKTLKDQDKIKLGNITLTL
LHHPGHTKGSCSFIFETKDEKRKYRVLIANMPSVIVDKKFSEVTAYPNIQ
SDYAYTFGVMKKLDFDIWVASHASQFDLHEKRKEGDPYNPQLFMDKQSYF
QNLNDLEKSYLNKIKKDSQDK
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5k0w Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5k0w Crystal Structure of the Metallo-beta-Lactamase GOB in the Periplasmic Dizinc Form Reveals an Unusual Metal Site.
Resolution2.61 Å
Binding residue
(original residue number in PDB)
Q98 H100 H175
Binding residue
(residue number reindexed from 1)
Q79 H81 H156
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) Q98 H100 D102 H103 H175 K207 H241
Catalytic site (residue number reindexed from 1) Q79 H81 D83 H84 H156 K188 H222
Enzyme Commision number ?
External links