Structure of PDB 1vj0 Chain B Binding Site BS02

Receptor Information

>1vj0 Chain B (length=364) Species: 2336 (Thermotoga maritima) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

LKAHAMVLEKFNQPLVYKEFEISDIPRGSILVEILSAGVCGSDVHMFRGE
DPRVPLPIILGHEGAGRVVEVNGEKRDLNGELLKPGDLIVWNRGITCGEC
YWCKVSKEPYLCPNRKVYGINRGCSEYPHLRGCYSSHIVLDPETDVLKVS
EKDDLDVLAMAMCSGATAYHAFDEYPESFAGKTVVIQGAGPLGLFGVVIA
RSLGAENVIVIAGSPNRLKLAEEIGADLTLNRRETSVEERRKAIMDITHG
RGADFILEATGDSRALLEGSELLRRGGFYSVAGVAVPQDPVPFKVYEWLV
LKNATFKGIWVSDTSHFVKTVSITSRNYQLLSKLITHRLPLKEANKALEL
MESREALKVILYPE

Ligand information

Ligand ID

InChI

InChI=1S/Zn/q+2

InChIKey

PTFCDOFLOPIGGS-UHFFFAOYSA-N

SMILES

Software	SMILES
CACTVS 3.341	[Zn++]
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Zn+2]

Formula

Name

ZINC ION

PDB chain

1vj0 Chain B Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

Global view

Local view

Structure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]

PDB	1vj0 Crystal structure of Alcohol dehydrogenase (TM0436) from Thermotoga maritima at 2.00 A resolution
Resolution	2.0 Å
Binding residue (original residue number in PDB)	C43 H65 E66 C166
Binding residue (residue number reindexed from 1)	C40 H62 E63 C163
Annotation score	1

Enzymatic activity

Catalytic site (original residue number in PDB)	C43 G44 S45 H48 H65 E66 C100 C103 C106 C115 K119 C166 T170 K361
Catalytic site (residue number reindexed from 1)	C40 G41 S42 H45 H62 E63 C97 C100 C103 C112 K116 C163 T167 K358
Enzyme Commision number	1.1.1.1: alcohol dehydrogenase.

Gene Ontology

	Molecular Function
GO:0016491	oxidoreductase activity
GO:0046872	metal ion binding

View graph for
Molecular Function

External links

PDB	RCSB:1vj0, PDBe:1vj0, PDBj:1vj0
PDBsum	1vj0
PubMed
UniProt	Q9WYR7

[Back to BioLiP]