Structure of PDB 7fso Chain D Binding Site BS01

Receptor Information
>7fso Chain D (length=191) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
IKQGIREVILCKDQDGKIGLRLKSIDNGIFVQLVQANSPASLVGLRFGDQ
VLQINGENCAGWSSDKAHKVLKQAFGEKITMTIRDRPFERTITMHKDSTG
HVGFIFKNGKITSIVKDSSAARNGLLTEHNICEINGQNVIGLKDSQIADI
LSTSGTVVTITIMPAFIFEHIIKRMAPSIMKSLMDHTIPEV
Ligand information
Ligand IDLJA
InChIInChI=1S/C9H11N3O2/c1-6(13)11-7-3-2-4-8(5-7)12-9(10)14/h2-5H,1H3,(H,11,13)(H3,10,12,14)
InChIKeyGVNXANNAMKHSRF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385CC(=O)Nc1cccc(NC(N)=O)c1
ACDLabs 12.01N(C(C)=O)c1cccc(c1)NC(N)=O
OpenEye OEToolkits 2.0.6CC(=O)Nc1cccc(c1)NC(=O)N
FormulaC9 H11 N3 O2
NameN-[3-(carbamoylamino)phenyl]acetamide
ChEMBL
DrugBank
ZINCZINC000000349236
PDB chain7fso Chain D 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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PDB7fso SDCBP PanDDA analysis group deposition
Resolution1.9 Å
Binding residue
(original residue number in PDB)		F213 D251 S252
Binding residue
(residue number reindexed from 1)		F106 D144 S145
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:7fso, PDBe:7fso, PDBj:7fso
PDBsum7fso
PubMed
UniProtO00560|SDCB1_HUMAN Syntenin-1 (Gene Name=SDCBP)

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