Structure of PDB 1atg Chain A Binding Site BS01

Receptor Information
>1atg Chain A (length=231) Species: 354 (Azotobacter vinelandii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ELKVVTATNFLGTLEQLAGQFAKQTGHAVVISSGSSGPVYAQIVNGAPYN
VFFSADEKSPEKLDNQGFALPGSRFTYAIGKLVLWSAKPGLVDNQGKVLA
GNGWRHIAISNPQIAPYGLAGTQVLTHLGLLDKLTAQERIVEANSVGQAH
SQTASGAADLGFVALAQIIQAAAKIPGSHWFPPANYYEPIVQQAVITKST
AEKANAEQFMSWMKGPKAVAIIKAAGYVLPQ
Ligand information
Ligand IDWO4
InChIInChI=1S/4O.W/q;;2*-1;
InChIKeyPBYZMCDFOULPGH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0[O-][W](=O)(=O)[O-]
ACDLabs 10.04
CACTVS 3.341
[O-][W]([O-])(=O)=O
FormulaO4 W
NameTUNGSTATE(VI)ION
ChEMBL
DrugBank
ZINC
PDB chain1atg Chain A Residue 250 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1atg Ligand size is a major determinant of specificity in periplasmic oxyanion-binding proteins: the 1.2 A resolution crystal structure of Azotobacter vinelandii ModA.
Resolution1.2 Å
Binding residue
(original residue number in PDB)
A8 T9 N10 S36 S37 A56 A116 P117 Y118 S146 V147
Binding residue
(residue number reindexed from 1)
A7 T8 N9 S35 S36 A55 A115 P116 Y117 S145 V146
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030973 molybdate ion binding
GO:0046872 metal ion binding
Biological Process
GO:0015689 molybdate ion transport
Cellular Component
GO:0030288 outer membrane-bounded periplasmic space

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Cellular Component
External links
PDB RCSB:1atg, PDBe:1atg, PDBj:1atg
PDBsum1atg
PubMed9862806
UniProtQ7SIH2

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