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Ligand · 0BH

0BH · N-[[(3R)-1-[6-(1-benzothiophen-4-ylmethylamino) pyrimidin-4-yl]-3-oxidanyl-piperidin-3-yl]methyl]-2-oxidanyl-4-[[(3S)-3-propan-2-yl-2-azaspiro[3.3]heptan-2-yl]methyl]benzamide

0BH, N-[[(3R)-1-[6-(1-benzothiophen-4-ylmethylamino) pyrimidin-4-yl]-3-oxidanyl-piperidin-3-yl]methyl]-2-oxidanyl-4-[[(3S)-3-propan-2-yl-2-azaspiro[3.3]heptan-2-yl]methyl]benzamide (C36 H44 N6 O3 S, 640.9 g/mol), in the MolNFT structures…

Component
0BH
Formula
C36 H44 N6 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0BH in 2 structures; the first of them:

  • 7OQP · Crystal structure of the human METTL3-METTL14 complex with compound UOZ113 · 0BH A601 · binds CYS376, ASP377, ILE378, ARG379, ASP395, PRO396, PRO397, TRP398 and 19 more
  • 7OQP · Crystal structure of the human METTL3-METTL14 complex with compound UOZ113 · 0BH A601 · binds CYS376, ASP377, ILE378, ARG379, ASP395, PRO396, PRO397, TRP398 and 16 more

Residues it binds most

TRP 2, GLY 2, ARG 2, ASP 2, PRO 2, THR 2, ASN 2, CYS 2, GLN 2, GLU 2 (residue and the binding sites it lines).

Found with

  • ACT · Acetate ion

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