GL1X · GenesisL1 explorer

Ligand · 55X

55X · S-{1-[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,7-dihydroxy-6,6-dimethyl-3-oxido-8,12 -dioxo-2,4-dioxa-9,13-diaza-3lambda~5~-phosphapentadecan-15-yl} (2S,6R)-6-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta [a]phenanthren-17-yl]-2-methylheptanethioate (non-preferred name)

55X, S-{1-[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,7-dihydroxy-6,6-dimethyl-3-oxido-8,12 -dioxo-2,4-dioxa-9,13-diaza-3lambda~5~-phosphapentadecan-15-yl}…

Component
55X
Formula
C48 H75 N7 O15 P2 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

55X in 1 structure; the first of them:

  • 5CW8 · Crystal structure of Mycobacterium tuberculosis KstR in complex with… · 55X A201 · binds MET26, LEU68, GLU71, PHE72, ILE75, LEU100, ALA103, MET104 and 12 more

Residues it binds most

LEU 2, MET 2, GLU 2, ILE 2, ALA 2, ARG 2, PHE 2, SER 2, THR 2, TRP 2 (residue and the binding sites it lines).

Found with

  • PGE · Triethylene glycol

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