Structure of PDB 3it0 Chain A Binding Site BS01

Receptor Information
>3it0 Chain A (length=329) Species: 376619 (Francisella tularensis subsp. holarctica LVS) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKLIFVSMITRHGDRAPFANIENANYSWGTELSELTPIGMNQEYNLGLQL
RKRYIDKFGLLPEHYVDQSIYVLSSHTNRTVVSAQSLLMGLYPAGTGPLI
GDGDPAIKDRFQPIPIMTLSADSRLIQFPYEQYLAVLKKYVYNSPEWQNK
TKEAAPNFAKWQQILGNRISGLNDVITVGDVLIVAQAHGKPLPKGLSQED
ADQIIALTDWGLAQQFKSQKVSYIMGGKLTNRMIEDLNNAVNGKSKYKMT
YYSGHDLTLLEVMGTLGVPLDTAPGYASNLEMELYKDGDIYTVKLRYNGK
YVKLPIMDKNNSCSLDALNKYMQSINEKF
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 chain3it0 Chain A Residue 343 [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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PDB3it0 Crystal Structures of the histidine acid phosphatase from Francisella tularensis provide insight into substrate recognition.
Resolution1.692 Å
Binding residue
(original residue number in PDB)		R16 H17 R20 R84 H260 D261
Binding residue
(residue number reindexed from 1)		R11 H12 R15 R79 H255 D256
Annotation score3
External links