PDBsum entry 4s1b

Ligand/metal interactions

PDB id

4s1b


	2 instances of ligand highlighted
	2BA

Ligands

2BA ×2

2BA 803(A)

Metals

_FE ×4

FE 801(A)

FE 802(A)

Ligand 2BA - (2r,3r,3as,5r,7ar,9r,10r,10as,12r,14ar)-2,9-Bis(6- Amino-
9h-Purin-9-Yl)octahydro-2h,7h-Difuro[3,2-D:3', 2'-
J][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5, 10,12-
Tetrol 5,12-Dioxide
[Bis-(3',5')-Cyclic-Dimeric-Adenosine-Monophosphate]
Formula: C₂₀H₂₄N₁₀O₁₂P₂

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
2BA 803(A)	44	44	0	0	Complete		Chiral checks - OK

Advanced Analysis

Residue	Name Mismatches	Count
2BA 803(A)	O2P: O1P\|O1P: O2P	2

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 2BA

List of
interactions

2BA 803(A)

(also representing equivalent ligand 2BA 803(D) )