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Ligand · KOS

KOS · 17-desmethoxy-17-N,N-dimethylaminoethylamino-geldanamycin

KOS, 17-desmethoxy-17-N,N-dimethylaminoethylamino-geldanamycin (C32 H48 N4 O8, 616.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
KOS
Formula
C32 H48 N4 O8
Class
ligand
Structures
2
PDB entries
1

Binding sites

KOS in 2 structures; the first of them:

  • 1OSF · Human Hsp90 in complex with 17-desmethoxy-17-N,N-Dimethylaminoethylamino-Geldanamycin · KOS A280 · binds ASN51, SER52, ASP54, ALA55, LYS58, ASP93, ILE96, MET98 and 10 more
  • 1OSF · Human HSP90 in complex with 17-desmethoxy-17-N,N- dimethylaminoethylamino-geldanamycin · KOS A280 · binds ASN51, SER52, ASP54, ALA55, LYS58, ASP93, ILE96, MET98 and 10 more

Residues it binds most

ASP 2, ASN 2, GLY 2, LYS 2, ALA 2, ILE 2, LEU 2, MET 2, PHE 2, SER 2 (residue and the binding sites it lines).

Found with

  • ACY · Acetic acid
  • MPD · (4S)-2-methyl-2,4-pentanediol

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