PDBsum entry 4mkc

Ligand/metal interactions

PDB id

4mkc


	Ligand highlighted
	4MK

Ligands

GOL ×2

GOL 1501(A)

GOL 1502(A)

4MK

4MK 1503(A)

Ligand 4MK - 5-Chloro-N~2~-[5-Methyl-4-(Piperidin-4-Yl)-2-(Propan-2-
Yloxy)phenyl]-N~4~-[2-(Propan-2-
Ylsulfonyl) phenyl]pyrimidine-2,4-Diamine
[Ceritinib; ldk378]
Formula: C₂₈H₃₆ClN₅O₃S

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
4MK 1503(A)	38	38	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 4MK

List of
interactions

4MK 1503(A)