Structure of PDB 7qpl Chain A Binding Site BS01

Receptor Information
>7qpl Chain A (length=295) Species: 224914 (Brucella melitensis bv. 1 str. 16M) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VSLVATLIANPAKAALAPSLGIKASAAVNATGLYWLADDIACDIPLPLGM
EASEADASLRATLDGAPIDVVVQEQERRRKKILIADMDSTMIGQECIDEL
AEEAGLRDHVAAITARAMNGEIAFEPALRERVALLKGLPLSVIDKVISTR
ITLTPGGPQLVRTMRKHGAYTALVSGGFTSFTRRIAEMIGFNEERANRLI
DDGTRLTGTVAEPILGREAKVEKLVEIAERVGLTPEDAIAVGDGANDLGM
IQLAGTGVALHAKPAVAAQAKMRIDHGDLTALLYIQGYRKADFVQ
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain7qpl Chain A Residue 415 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7qpl Crystal structure of phosphoserine phosphatase (SerB) from Brucella melitensis in complex with phosphate and magnesium
Resolution1.77 Å
Binding residue
(original residue number in PDB)
D94 D96 D251
Binding residue
(residue number reindexed from 1)
D86 D88 D243
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.3: phosphoserine phosphatase.
Gene Ontology
Molecular Function
GO:0036424 L-phosphoserine phosphatase activity
Biological Process
GO:0006564 L-serine biosynthetic process

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Molecular Function

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Biological Process
External links
PDB RCSB:7qpl, PDBe:7qpl, PDBj:7qpl
PDBsum7qpl
PubMed
UniProtQ8YI30

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