Structure of PDB 5zon Chain C Binding Site BS03

Receptor Information
>5zon Chain C (length=256) Species: 83332 (Mycobacterium tuberculosis H37Rv) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HDDLMLALALADRADELTRVRFGALDLRIDTKPDLTPVTDADRAVESDVR
QTLGRDRPGDGVLGEEFGGSTTFTGRQWIVDPIDGTKNFVRGVPVWASLI
ALLEDGVPSVGVVSAPALQRRWWAARGRGAFASVDGARPHRLSVSSVAEL
HSASLSFSSLSGWARPGLRERFIGLTDTVWRVRAYGDFLSYCLVAEGAVD
IAAEPQVSVWDLAALDIVVREAGGRLTSLDGVAGPHGGSAVATNGLLHDE
VLTRLN
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 chain5zon Chain C Residue 304 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5zon Identification and structural characterization of a histidinol phosphate phosphatase from Mycobacterium tuberculosis
Resolution1.94 Å
Binding residue
(original residue number in PDB)		E67 I85 G87 T88
Binding residue
(residue number reindexed from 1)		E65 I83 G85 T86
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.15: histidinol-phosphatase.
Gene Ontology
Molecular Function
GO:0004401 histidinol-phosphatase activity
GO:0008934 inositol monophosphate 1-phosphatase activity
GO:0016787 hydrolase activity
GO:0016791 phosphatase activity
GO:0042578 phosphoric ester hydrolase activity
GO:0046872 metal ion binding
Biological Process
GO:0000105 L-histidine biosynthetic process
GO:0010125 mycothiol biosynthetic process
Cellular Component
GO:0005829 cytosol
GO:0005886 plasma membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5zon, PDBe:5zon, PDBj:5zon
PDBsum5zon
PubMed29752410
UniProtP95189|HISN_MYCTU Histidinol-phosphatase (Gene Name=hisN)

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