Structure of PDB 2fim Chain A Binding Site BS01

Receptor Information
>2fim Chain A (length=224) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PREFVLRPAPQGRTVRCRLTRDKYPSYFLHLDTEKKVFLLAGRKRKRSKT
ANYLISIDPTNNFIGKLRSNLLGNRFTVFDNGQNPQRGYSTNVASLRQEL
AAVIYERRMTVIIPGMSAENERVPIRPRNASDGLLVRWQNKTLESLIELH
NKPPVWNDDSGSYTLNFQGRVTQASVKNFQIVHADDPDYIVLQFGRVAED
AFTLDYRYPLCALQAFAIALSSFD
Ligand information
Ligand ID3DP
InChIInChI=1S/C13H29NO3S/c1-4-5-6-7-8-9-11-14(2,3)12-10-13-18(15,16)17/h4-13H2,1-3H3
InChIKeyQZRAABPTWGFNIU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0CCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
ACDLabs 10.04[O-]S(=O)(=O)CCC[N+](C)(CCCCCCCC)C
CACTVS 3.341CCCCCCCC[N+](C)(C)CCC[S]([O-])(=O)=O
FormulaC13 H29 N O3 S
Name3-(N,N-DIMETHYLOCTYLAMMONIO)PROPANESULFONATE
ChEMBL
DrugBank
ZINC
PDB chain2fim Chain A Residue 1003 [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]
PDB2fim Structure of the C-terminal domain of Human Tubby-like protein 1
Resolution1.9 Å
Binding residue
(original residue number in PDB)		Y448 R466
Binding residue
(residue number reindexed from 1)		Y189 R207
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:2fim, PDBe:2fim, PDBj:2fim
PDBsum2fim
PubMed
UniProtO00294|TULP1_HUMAN Tubby-related protein 1 (Gene Name=TULP1)

[Back to BioLiP]