PDBsum entry 1soj

Ligand/metal interactions

PDB id

1soj


	12 instances of ligand highlighted
	IBM

Ligands

IBM ×12

IBM 2111(A)

Metals

_MG ×24

MG 2123(A)

MG 2124(A)

Ligand IBM - 3-Isobutyl-1-Methylxanthine
Formula: C₁₀H₁₄N₄O₂

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
IBM 2111(A)	16	16	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 IBM

List of
interactions

IBM 2111(A)

also representing 11 other equivalent ligands:
IBM 2112(B)
IBM 2113(C)
IBM 2114(D)
IBM 2115(E)
IBM 2116(F)
IBM 2117(G)
IBM 2118(H)
IBM 2119(I)
IBM 2120(J)
IBM 2121(K)
IBM 2122(L)