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PDBsum entry 2amq

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Ligand/metal interactions PDB id
2amq
2 instances of ligand highlighted
02J-ALA-VAL-LEU-
PJE-010
Ligands
02J-ALA-VAL-LEU-
PJE-010
×2
02J 1(C) to 010 6(C)
  
Ligand 02J-ALA-VAL-LEU-PJE-010

02J - 5-Methyl-1,2-Oxazole-3-Carboxylic acid Formula: C5H5NO3
PJE - (E,4s)-4-Azanyl-5-[(3s)-2-Oxidanylidenepyrrolidin-3- Yl]pent-2-Enoic acid Formula: C9HNN2O3
010 - Phenylmethanol Formula: C7H8O
Validation of ligand annotation
Per Residue Validation
Atoms Missing Incorrect Chiral Centres
Residue Dic. Struc. Link Subs. Atoms Rings Planar High C Other
02J 1(C) 9 9 1 1 Complete Chiral checks - OK
ALA 2(C) 6 - - - Residue too small to validate
VAL 3(C) 8 8 1 1 Complete Chiral checks - OK
LEU 4(C) 9 9 1 1 Complete Chiral checks - OK
PJE 5(C) 14 14 1 0 Complete Chiral checks - OK
010 6(C) 8 8 0 0 Complete Chiral checks - OK
Advanced Analysis
Residue Name Mismatches Count
02J 1(C) - 0
ALA 2(C) - 0
VAL 3(C) - 0
LEU 4(C) O: OXT 1
PJE 5(C) O7: O6 1
010 6(C) - 0
Additional Information
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LIGPLOT of interactions involving ligand 02J-ALA-VAL-LEU-PJE-010

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List of
interactions
 


02J 1(C) to 010 6(C)

(also representing equivalent ligand 02J 1(D) to 010 6(D) )
  
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