Ligand · UT6

UT6 · (1~{S},5~{S},6~{R})-10-[3,5-bis(chloranyl)phenyl]sulfinyl-5-ethenyl-3-(pyridin-2-ylmethyl)-3,10-diazabicyclo[4.3.1]decan-2-one

UT6, (1~{S},5~{S},6~{R})-10-[3,5-bis(chloranyl)phenyl]sulfinyl-5-ethenyl-3-(pyridin-2-ylmethyl)-3,10-diazabicyclo[4.3.1]decan-2-one (C22 H23 Cl2 N3 O2 S, 464.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component: UT6
Formula: C22 H23 Cl2 N3 O2 S
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

UT6 in 1 structure; the first of them:

8CHM · Human FKBP12 in complex with (1S,5S,6R)-10-((S)-(3,5-dichlorophenyl)sulfinyl)-3-(pyridin-2… · UT6 A201 · binds TYR26, PHE36, ASP37, PHE46, GLU54, VAL55, ILE56, TRP59 and 4 more

Residues it binds most

PHE 1, ILE 1, TYR 1, ASP 1, GLU 1, HIS 1, TRP 1, VAL 1 (residue and the binding sites it lines).

Found with

CD · Cadmium ion
CL · Chloride ion
SO4 · Sulfate ion
DMS · Dimethyl sulfoxide

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