Structure of PDB 5rzb Chain A Binding Site BS01

Receptor Information
>5rzb 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 IDSFY
InChIInChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)
InChIKeyGECHUMIMRBOMGK-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01O=S(=O)(Nc1ncccc1)c2ccc(N)cc2
CACTVS 3.370Nc1ccc(cc1)[S](=O)(=O)Nc2ccccn2
OpenEye OEToolkits 1.7.6c1ccnc(c1)NS(=O)(=O)c2ccc(cc2)N
FormulaC11 H11 N3 O2 S
Name4-amino-N-(pyridin-2-yl)benzenesulfonamide;
Sulfapyridine
ChEMBLCHEMBL700
DrugBankDB00891
ZINCZINC000000002105
PDB chain5rzb Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5rzb EPB41L3 PanDDA analysis group deposition
Resolution1.59 Å
Binding residue
(original residue number in PDB)		C316 S318 L321 R331 A333
Binding residue
(residue number reindexed from 1)		C210 S212 L215 R225 A227
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008092 cytoskeletal protein binding
Cellular Component
GO:0005856 cytoskeleton

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Molecular Function
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Cellular Component
External links
PDB RCSB:5rzb, PDBe:5rzb, PDBj:5rzb
PDBsum5rzb
PubMed
UniProtQ9Y2J2|E41L3_HUMAN Band 4.1-like protein 3 (Gene Name=EPB41L3)

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