GL1X · GenesisL1 explorer

Ligand · 9BW

9BW · (2~{S},4~{R})-1-[(2~{S})-2-(cyclopropylcarbonylamino)-3,3-dimethyl-butanoyl]-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide

9BW, (2~{S},4~{R})-1-[(2~{S})-2-(cyclopropylcarbonylamino)-3,3-dimethyl-butanoyl]-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide (C26 H34 N4 O4 S, 498.6 g/mol), in the MolNFT structures on…

Component
9BW
Formula
C26 H34 N4 O4 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

9BW in 1 structure; the first of them:

  • 5NVW · pVHL:EloB:EloC in complex with (2S,4R)-1-((S)-2-(cyclopropanecarboxamido)-3,3-dimethylbuta… · 9BW C301 · binds ASN67, ARG69, PHE76, PRO86, TRP88, PHE91, TYR98, PRO99 and 9 more

Residues it binds most

ARG 4, HIS 4, PHE 4, PRO 4, TRP 4, TYR 4, ASN 4, ILE 4, LEU 4, SER 4 (residue and the binding sites it lines).

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