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Ligand · DYX

DYX · 1-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)-5,5-bis(oxidanylidene)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]cyclopentane-1-carboxamide

DYX, 1-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)-5,5-bis(oxidanylidene)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]cyclopentane-1-carboxamide (C24 H24 Cl N3 O4 S, 486.0 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (3 PDB…

Component
DYX
Formula
C24 H24 Cl N3 O4 S
Class
ligand
Structures
4
PDB entries
3

Binding sites

DYX in 4 structures; the first of them:

  • 6KX8 · Crystal structure of mouse Cryptochrome 2 in complex with TH301 compound · DYX A601 · binds GLN307, TRP310, ARG311, PHE314, HIS373, ARG376, HIS377, ALA380 and 9 more
  • 6KX7 · Crystal structure of mouse cryptochrome 1 in complex with TH301 compound · DYX A501 · binds GLN289, TRP292, ARG293, PHE296, HIS355, ARG358, HIS359, ALA362 and 10 more
  • 6KX8 · Crystal structure of mouse cryptochrome 2 in complex with TH301 compound · DYX A601 · binds GLN307, TRP310, ARG311, PHE314, HIS373, ARG376, HIS377, ALA380 and 8 more
  • 7EJ9 · Alternative crystal structure of mouse cryptochrome 2 in complex with TH301 compound · DYX A601 · binds GLN307, TRP310, ARG311, PHE314, HIS373, ARG376, HIS377, ALA380 and 9 more

Residues it binds most

TRP 7, ARG 7, HIS 7, PHE 7, ALA 7, LEU 6, ASN 7, ASP 7, GLN 7, SER 7 (residue and the binding sites it lines).

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