Structure of PDB 5rza Chain A Binding Site BS02

Receptor Information
>5rza Chain A (length=284) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PKSMQCKVILLDGSEYTCDVEKRSRGQVLFDKVCEHLNLLEKDYFGLTYR
DAENQKNWLDPAKEIKKQVRSGAWHFSFNVKFYPPDPAQLSEDITRYYLC
LQLRDDIVSGRLPCSFVTLALLGSYTVQSELGDYDPDECGSDYISEFRFA
PNHTKELEDKVIELHKSHRGMTPAEAEMHFLENAKKLSMYGVDLHHAKDS
EGVEIMLGVCASGLLIYRDRLRINRFAWPKVLKISYKRNNFYIKIRPGEF
EQFESTIGFKLPNHRAAKRLWKVCVEHHTFFRLL
Ligand information
Ligand IDWHM
InChIInChI=1S/C10H12FNO2S/c11-10-4-1-3-9(7-10)8-12-5-2-6-15(12,13)14/h1,3-4,7H,2,5-6,8H2
InChIKeyRVDJKNWVTKGWCE-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01c2(CN1CCCS1(=O)=O)cccc(c2)F
OpenEye OEToolkits 2.0.7c1cc(cc(c1)F)CN2CCCS2(=O)=O
CACTVS 3.385Fc1cccc(CN2CCC[S]2(=O)=O)c1
FormulaC10 H12 F N O2 S
Name2-[(3-fluorophenyl)methyl]-1lambda~6~,2-thiazolidine-1,1-dione
ChEMBL
DrugBank
ZINCZINC000071965017
PDB chain5rza Chain A Residue 402 [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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PDB5rza EPB41L3 PanDDA analysis group deposition
Resolution1.89 Å
Binding residue
(original residue number in PDB)		V337 L338 I340 H384
Binding residue
(residue number reindexed from 1)		V231 L232 I234 H278
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008092 cytoskeletal protein binding
Cellular Component
GO:0005856 cytoskeleton

View graph for
Molecular Function
View graph for
Cellular Component
External links
PDB RCSB:5rza, PDBe:5rza, PDBj:5rza
PDBsum5rza
PubMed
UniProtQ9Y2J2|E41L3_HUMAN Band 4.1-like protein 3 (Gene Name=EPB41L3)

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