Project Summary (5R,8S,11S)-5-methyl-8-(propan-2-yl)-11-[(1E)-4-sulfanylbut-1-en-1-yl]-3,17-dithia-7,10,14,19,20-pentaazatricyclo[14.2.1.1~2,5~]icosa-1(18),2(20),16(19)-triene-6,9,13-trione

Molecule information

Bioactive Conformational Ensemble ID	BAC0010656
Ligand ID	L6G
PDB ID	4RN0
Experiment Type	X-RAY DIFFRACTION
Resolution	1.76 Å
Subset(s)	Overall Benchmark

Molecule properties

Smiles

C(C/C=C/[C@@H]1CC(=O)NCc2nc([C@@H]3N[C@@](C(=O)N[C@H](C(=O)N1)C(C)C)(C)CS3)cs2)S

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(5r,8s,11s)-5-methyl-8-(propan-2-yl)-11-[(1e)-4-sulfanylbut-1-en-1-yl]-3,17-dithia-7,10,14,19,20-pentaazatricyclo[14.2.1.1~2,5~]icosa-1(18),2(20),16(19)-triene-6,9,13-trione (L6G) Summary