PDBsum entry 2c3p

Ligand/metal interactions

PDB id

2c3p


	2 instances of ligand highlighted
	1TP

Ligands

SF4 ×6

SF4 2233(A)

SF4 2234(A)

SF4 2235(A)

1TP ×2

1TP 2236(A)

Metals

_CA ×2

CA 2238(A)

_MG ×2

MG 2237(A)

Ligand 1TP - 1-(2-{(2s,4r,5r)-3-[(4-Amino-2-Methylpyrimidin-5-
Yl) methyl]-2-[(1s)-1-Carboxy-1-Hydroxyethyl]-4-Methyl-
1, 3-Thiazolidin-5-Yl}ethoxy)-1,1,3,3-Tetrahydroxy-
1lambda~5~-Diphosphox-1-En-2-Ium 3-Oxide
Formula: C₁₅H₂₆N₄O₁₀P₂S

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings
1TP 2236(A)	32	Degenerate residue

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 cofactor thiamine diphosphate with similarity 81.25%

LIGPLOT of interactions involving ligand 1TP

List of
interactions

1TP 2236(A)

(also representing equivalent ligand 1TP 2236(B) )