Structure of PDB 7fsv Chain C Binding Site BS01

Receptor Information
>7fsv 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 IDUQS
InChIInChI=1S/C10H10FN3/c11-10-4-2-1-3-8(10)5-12-9-6-13-14-7-9/h1-4,6-7,12H,5H2,(H,13,14)
InChIKeyPDSIYANAENEXNZ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(c(c1)CNc2c[nH]nc2)F
ACDLabs 12.01n2ncc(NCc1ccccc1F)c2
CACTVS 3.385Fc1ccccc1CNc2c[nH]nc2
FormulaC10 H10 F N3
NameN-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine
ChEMBL
DrugBank
ZINCZINC000035763759
PDB chain7fsv 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

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB7fsv SDCBP PanDDA analysis group deposition
Resolution2.25 Å
Binding residue
(original residue number in PDB)		N215 G216 N237 L249 I279 M287
Binding residue
(residue number reindexed from 1)		N110 G111 N132 L144 I174 M182
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:7fsv, PDBe:7fsv, PDBj:7fsv
PDBsum7fsv
PubMed
UniProtO00560|SDCB1_HUMAN Syntenin-1 (Gene Name=SDCBP)

[Back to BioLiP]