Structure of PDB 5rjo Chain A Binding Site BS01

Receptor Information
>5rjo Chain A (length=119) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
YDIQAWKKQCEELLNLIFQCEDSEPFRQPVDLLEYPDYRDIIDTPMDFAT
VRETLEAGNYESPMELCKDVRLIFSNSKAYTPSKRSRIYSMSLRLSAFFE
EHISSVLSDYKSALRFHKR
Ligand information
Ligand ID1P8
InChIInChI=1S/C8H6BrNO/c9-6-2-1-5-3-8(11)10-7(5)4-6/h1-2,4H,3H2,(H,10,11)
InChIKeyJARRYVQFBQVOBE-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01Brc1ccc2c(c1)NC(=O)C2
OpenEye OEToolkits 1.7.6c1cc2c(cc1Br)NC(=O)C2
CACTVS 3.370Brc1ccc2CC(=O)Nc2c1
FormulaC8 H6 Br N O
Name6-bromo-1,3-dihydro-2H-indol-2-one
ChEMBLCHEMBL2381492
DrugBank
ZINCZINC000002577874
PDB chain5rjo Chain A Residue 1501 [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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PDB5rjo PanDDA analysis group deposition of ground-state model
Resolution1.22 Å
Binding residue
(original residue number in PDB)		P1340 V1345 Y1350 Y1353 Y1395
Binding residue
(residue number reindexed from 1)		P25 V30 Y35 Y38 Y80
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5rjo, PDBe:5rjo, PDBj:5rjo
PDBsum5rjo
PubMed
UniProtQ8WWQ0|PHIP_HUMAN PH-interacting protein (Gene Name=PHIP)

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