Structure of PDB 3p7z Chain B Binding Site BS01

Receptor Information
>3p7z Chain B (length=270) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KFEEFMTRHQVHEKEEFKALKTLSIFYQAGTSKAGNPVFYYVARRFKTGQ
INGDLLIYHVLLTLKPYYAKPYEIVVDLTHTGPSNRFKTDFLSKWFVVFP
GFAYDNVSAVYIYNCNSWVREYTKYHERLLTGLKGSKRLVFIDCPGKLAE
HIEHEQQKLPAATLALEEDLKVFHNALKLAHKDTKVSIKVGSTAVQVTSA
ERTKVLGQSVFLNDIYYASEIEEICLVDENQFTLTIANQGTPLTFMHQEC
EAIVQSIIHIRTRWELSQPD
Ligand information
Ligand IDPOP
InChIInChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)/p-2
InChIKeyXPPKVPWEQAFLFU-UHFFFAOYSA-L
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0O[P@@](=O)([O-])O[P@@](=O)(O)[O-]
CACTVS 3.341O[P]([O-])(=O)O[P](O)([O-])=O
ACDLabs 10.04[O-]P(=O)(O)OP([O-])(=O)O
OpenEye OEToolkits 1.5.0OP(=O)([O-])OP(=O)(O)[O-]
FormulaH2 O7 P2
NamePYROPHOSPHATE 2-
ChEMBL
DrugBank
ZINC
PDB chain3p7z Chain B Residue 1817 [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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PDB3p7z Structural and biochemical consequences of NF1 associated nontruncating mutations in the Sec14-PH module of neurofibromin.
Resolution2.65 Å
Binding residue
(original residue number in PDB)		R1666 K1670
Binding residue
(residue number reindexed from 1)		R120 K124
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:3p7z, PDBe:3p7z, PDBj:3p7z
PDBsum3p7z
PubMed21089070
UniProtP21359|NF1_HUMAN Neurofibromin (Gene Name=NF1)

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