PDBsum entry 3myh

Ligand/metal interactions

PDB id

3myh


	Ligand highlighted
	BIT

Ligands

VO4-ADP

VO4 998(X) to ADP 999(X)

BIT

BIT 800(X)

Metals

_MG

MG 997(X)

Ligand BIT - (-)-1-Phenyl-1,2,3,4-Tetrahydro-4-Hydroxypyrrolo[2,3- B]-7-
Methylquinolin-4-One
[(S)-Blebbistatin; (3as)-3a-Hydroxy-6-Methyl-1-Phenyl-3, 3a-
Dihydro-1h-Pyrrolo[2,3-B]quinolin-4(2h)-One]
Formula: C₁₈H₁₆N₂O₂

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
BIT 800(X)	22	22	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 BIT

List of
interactions

BIT 800(X)