Structure of PDB 7ft2 Chain C Binding Site BS01

Receptor Information
>7ft2 Chain C (length=193) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AEIKQGIREVILCKDQDGKIGLRLKSIDNGIFVQLVQANSPASLVGLRFG
DQVLQINGENCAGWSSDKAHKVLKQAFGEKITMTIRDRPFERTITMHKDS
TGHVGFIFKNGKITSIVKDSSAARNGLLTEHNICEINGQNVIGLKDSQIA
DILSTSGTVVTITIMPAFIFEHIIKRMAPSIMKSLMDHTIPEV
Ligand information
Ligand IDJFS
InChIInChI=1S/C14H12N2O/c17-9-11-5-7-12(8-6-11)16-10-15-13-3-1-2-4-14(13)16/h1-8,10,17H,9H2
InChIKeyIRZKUEWQJPIBJF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01c1(ccc(CO)cc1)n3c2ccccc2nc3
CACTVS 3.385OCc1ccc(cc1)n2cnc3ccccc23
OpenEye OEToolkits 2.0.6c1ccc2c(c1)ncn2c3ccc(cc3)CO
FormulaC14 H12 N2 O
Name[4-(1H-benzimidazol-1-yl)phenyl]methanol
ChEMBL
DrugBank
ZINCZINC000000168836
PDB chain7ft2 Chain C Residue 301 [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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PDB7ft2 SDCBP PanDDA analysis group deposition
Resolution2.04 Å
Binding residue
(original residue number in PDB)		R128 M282 I286
Binding residue
(residue number reindexed from 1)		R23 M177 I181
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:7ft2, PDBe:7ft2, PDBj:7ft2
PDBsum7ft2
PubMed
UniProtO00560|SDCB1_HUMAN Syntenin-1 (Gene Name=SDCBP)

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