Ligand · 9BK
9BK · (2~{S},4~{R})-1-[(2~{S})-2-[(1-acetamidocyclopropyl)carbonylamino]-3,3-dimethyl-butanoyl]-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide
9BK, (2~{S},4~{R})-1-[(2~{S})-2-[(1-acetamidocyclopropyl)carbonylamino]-3,3-dimethyl-butanoyl]-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide (C28 H37 N5 O5 S, 555.7 g/mol), in the MolNFT structures…
- Component
- 9BK
- Formula
- C28 H37 N5 O5 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
9BK in 2 structures; the first of them:
- 5NW0 · pVHL:EloB:EloC in complex with (2S,4R)-1-((S)-2-(1-acetamidocyclopropanecarboxamido)-3,3-d… · 9BK C301 · binds ASN67, ARG69, PHE76, PRO86, TRP88, PHE91, TYR98, PRO99 and 9 more
- 5NW0 · PVHL:ELOB:ELOC in complex with (2S,4R)-1-((S)-2-(1… · 9BK C301 · binds ASN67, ARG69, PHE76, PRO86, TRP88, PHE91, TYR98, PRO99 and 9 more
Residues it binds most
ARG 8, HIS 8, PHE 8, PRO 8, TRP 8, TYR 8, ASN 8, ILE 8, LEU 8, SER 8 (residue and the binding sites it lines).
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