GL1X · GenesisL1 explorer

Ligand · L86

L86 · (11S)-11-benzyl-6-chloro-1,2,10,11,12,13,14,15,16,17,18,19-dodecahydro-5,9-methano-2,5,8,10,13,17-benzohexaazacycloheni cosine-3,24-dione

L86, (11S)-11-benzyl-6-chloro-1,2,10,11,12,13,14,15,16,17,18,19-dodecahydro-5,9-methano-2,5,8,10,13,17-benzohexaazacycloheni cosine-3,24-dione (C27 H33 Cl N6 O2, 509.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
L86
Formula
C27 H33 Cl N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

L86 in 2 structures; the first of them:

  • 1NM6 · thrombin in complex with selective macrocyclic inhibitor at 1.8A · L86 A247 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 12 more
  • 1NM6 · Thrombin in complex with selective macrocyclic inhibitor at 1.8A · L86 A247 · binds HIS57, TYR60A, TRP60D, GLU97A, ASN98, LEU99, ILE174, ASP189 and 12 more

Residues it binds most

GLU 2, GLY 2, CYS 2, SER 2, TRP 2, ALA 2, ASN 2, ASP 2, HIS 2, ILE 2 (residue and the binding sites it lines).

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