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Ligand · B5G

B5G · (2R)-N-(3-cyanophenyl)-2-{3-[(5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl) carbamoyl]phenyl}pyrrolidine-1-carboxamide

B5G, (2R)-N-(3-cyanophenyl)-2-{3-[(5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl) carbamoyl]phenyl}pyrrolidine-1-carboxamide (C26 H26 N6 O2 S, 486.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
B5G
Formula
C26 H26 N6 O2 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

B5G in 1 structure; the first of them:

  • 5WNH · X-ray co-structure of rho-associated protein kinase (ROCK1) with a highly selective… · B5G A900 · binds ILE82, ARG84, GLY85, ALA86, PHE87, GLY88, GLU89, VAL90 and 14 more

Residues it binds most

ALA 4, GLY 4, PHE 4, LEU 4, MET 4, ASP 4, GLU 4, VAL 4, ILE 4, LYS 4 (residue and the binding sites it lines).

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