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PDBsum entry 4ya9
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Ligand/metal interactions PDB id
4ya9
6 instances of ligand highlighted
ACE-LEU-ALA-ASJ-
POL
Ligands
ACE-LEU-ALA-ASJ-
POL ×6
ACE 1(c) to POL 5(c)
ACE 1(d) to POL 5(d)
ACE 1(e) to POL 5(e)
MES ×4
MES 302(K)
MES 302(c)
Metals
_MG ×8
MG 301(G)
MG 302(I)
MG 201(J)
MG 301(L)
MG 201(N)
MG 301(W)
MG 301(I)
_CL
CL 301(U)
__K ×2
K 102(f)
  
Ligand ACE-LEU-ALA-ASJ-POL

ACE - Acetyl group Formula: C2H4O
ASJ - (3s)-3-Amino-4-Hydroxybutanoic acid Formula: C4H9NO3
POL - N-Propanol [1-Proponol] Formula: C3H8O
Validation of ligand annotation
Per Residue Validation
Atoms Missing Incorrect Chiral Centres
Residue Dic. Struc. Link Subs. Atoms Rings Planar High C Other
ACE 1(c) 3 - - - Residue too small to validate
LEU 2(c) 9 9 1 1 Complete Chiral checks - OK
ALA 3(c) 6 - - - Residue too small to validate
ASJ 4(c) 8 8 1 0 Complete Chiral checks - OK
POL 5(c) 4 - - - Residue too small to validate
Advanced Analysis
Residue Name Mismatches Count
ACE 1(c) - 0
LEU 2(c) O: OXT 1
ALA 3(c) - 0
ASJ 4(c) OD2: OD1|OD1: OD2 2
POL 5(c) - 0
Additional Information
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LIGPLOT of interactions involving ligand ACE-LEU-ALA-ASJ-POL

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List of
interactions
 

ACE 1(c) to POL 5(c)

(also representing equivalent ligand ACE 1(f) to POL 5(f) )
  
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