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Ligand · C2K

C2K · (3~{S})-~{N}-[1-(aminomethyl)cyclopropyl]-19-chloranyl-5-oxidanylidene-9-(trifluoromethyl)-12,17-dioxa-4-azatricyclo[16.2.2.0^{6,11}]docosa-1(20),6(11),7,9,18,21-hexaene-3-carboxamide

C2K, (3~{S})-~{N}-[1-(aminomethyl)cyclopropyl]-19-chloranyl-5-oxidanylidene-9-(trifluoromethyl)-12,17-dioxa-4-azatricyclo[16.2.2.0^{6,11}]docosa-1(20),6(11),7,9,18,21-hexaene-3-carboxamide (C25 H27 Cl F3 N3 O4, 526.0 g/mol), in the MolNFT…

Component
C2K
Formula
C25 H27 Cl F3 N3 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

C2K in 1 structure; the first of them:

  • 6EX8 · Crystal Structure of Rhodesain in complex with a Macrolactam Inhibitor · C2K A301 · binds GLN19, CYS22, GLY23, SER24, CSX25, TRP26, ASP60, PHE61 and 13 more

Residues it binds most

GLY 2, ALA 2, LEU 2, ASP 2, CYS 2, ASN 2, CSX 2, GLN 2, HIS 2, MET 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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