PDBsum entry 2gci

Ligand/metal interactions

PDB id

2gci


	4 instances of ligand highlighted
	MRR

Ligands

MRR ×4

MRR 1751(A)

GOL ×6

GOL 1306(A)

GOL 1305(B)

Ligand MRR - (R)-2-Methylmyristoyl-Coenzyme a
[[5-(6-Aminopurin-9-Yl)-2-[[[[3-[2-(2-(R)-2-
Methyltetradecanoyl)-
Sulfanylethylcarbamoyl ethylcarbamoyl]-3-Hydroxy-2,2-
Dimethyl-Propoxy]- Hydroxy-Phosphoryl]oxy-Hydroxy-
Phosphoryl]oxymethyl]- 4-Hydroxy-Oxolan-3-
Yl]oxyphosphonic acid]
Formula: C₃₆H₆₄N₇O₁₇P₃S

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings
MRR 1751(A)	64	55	0	0	9	0

Advanced Analysis

Residue	Name Mismatches	Count
MRR 1751(A)	O8A: O7A\|O7A: O8A\|O5A: O4A\|O4A: O5A	4

Additional Information

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

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Ligand matches this enzyme's reactant (2S)-2-methylacyl-CoA with similarity 92.86%

LIGPLOT of interactions involving ligand MRR

List of
interactions

MRR 1751(A)

also representing 3 other equivalent ligands:
MRR 1752(B)
MRR 1753(C)
MRR 1754(D)