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PDBsum entry 1xpr

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Ligand/metal interactions PDB id
1xpr
6 instances of ligand highlighted
AGS
Ligands
__U-__C ×6
U 1(G) to C 2(G)
AGS ×6
AGS 1600(A)
_FB ×5
FB 2701(B)
FB 3701(C)
FB 4701(D)
FB 5701(E)
FB 6701(F)
Metals
_MG ×6
MG 1601(A)
  
Ligand AGS - Phosphothiophosphoric acid-Adenylate ester
[Atp-Gamma-S; adenosine 5'-(3-
Thiotriphosphate); adenosine 5'-(Gamma-
Thiotriphosphate); adenosine-5'-
Diphosphate monothiophosphate]

Formula: C10H16N5O12P3S
Validation of ligand annotation
Per Residue Validation
Atoms Missing Incorrect Chiral Centres
Residue Dic. Struc. Link Subs. Atoms Rings Planar High C Other
AGS 1600(A) 31 31 0 0 0 0 0 1 0 0
Advanced Analysis
Residue Name Mismatches Count
AGS 1600(A) O2B: O1B|O1B: O2B|O2A: O1A|O1A: O2A 4
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AGS 1600(A)

also representing 5 other equivalent ligands:
AGS 2600(B)
AGS 3600(C)
AGS 4600(D)
AGS 5600(E)
AGS 6600(F)
  
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