PDBsum entry 1xuo

Ligand/metal interactions

PDB id

1xuo


	Ligand highlighted
	LA1

Ligands

LA1

LA1 401(A)

Metals

_MG ×2

MG 312(B)

Ligand LA1 - (2r)-2-[3-Isobutyl-2,5-Dioxo-4-(Quinolin-3-Ylmethyl)-1, 4-
Diazepan-1-Yl]-N-Methyl-3-(2-Naphthyl)propanamide
[(S)-2-((S)-3-Isobutyl-2,5-Dioxo-4-Quinolin-3-Ylmethyl-
[1,4]diazepan-1yl)-N-Methyl-3-Naphtalen-2-Yl-
Propionamide]
Formula: C₃₃H₃₆N₄O₃

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
LA1 401(A)	40	40	0	0	Complete		Chiral checks - OK

Additional Information

Validation carried out using MotiveValidator. Full validation report can be found in Validator^DB.

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LIGPLOT of interactions involving ligand LA1

List of
interactions

LA1 401(A)