Structure of PDB 3db1 Chain C Binding Site BS01

Receptor Information
>3db1 Chain C (length=264) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RRGILVIRHGERVDQVFGKSWLQQCTTADGKYYRPDLNFPRSLPRRSNGI
KDFENDPPLSSCGIFQARLAGEALLDSGVRVTAVFASPALRCVQTAKHIL
EELKLEKKLKIRVEPGIFEWMKWEASKATLTFLTLEELKEANFNVDLDYR
PALPRCSLMPAESYDQYVERCAVSMGQIINTCPQDMGITLIVSHSSALDS
CTRPLLGLPPRECGDFAQLVRKIPSLGMCFCEENREDGKWDLVNPPVKTL
THGANSVFNWRNWI
Ligand information
Ligand IDPO4
InChIInChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3
InChIKeyNBIIXXVUZAFLBC-UHFFFAOYSA-K
SMILES
SoftwareSMILES
CACTVS 3.341[O-][P]([O-])([O-])=O
ACDLabs 10.04[O-]P([O-])([O-])=O
OpenEye OEToolkits 1.5.0[O-]P(=O)([O-])[O-]
FormulaO4 P
NamePHOSPHATE ION
ChEMBL
DrugBankDB14523
ZINC
PDB chain3db1 Chain C Residue 3 [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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PDB3db1 Structural and functional characterization of the 2H-phosphatase domain of Sts-2 reveals an acid-dependent phosphatase activity.
Resolution2.77 Å
Binding residue
(original residue number in PDB)		H366 E476 H551 S552
Binding residue
(residue number reindexed from 1)		H9 E119 H194 S195
Annotation score3
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:3db1, PDBe:3db1, PDBj:3db1
PDBsum3db1
PubMed19196006
UniProtQ3V3E1|UBS3A_MOUSE Ubiquitin-associated and SH3 domain-containing protein A (Gene Name=Ubash3a)

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