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PDBsum entry 4u72

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Ligand/metal interactions PDB id
4u72
4 instances of ligand highlighted
NHE
Ligands
HEM-PIM ×2
HEM 501(A) to PIM 502(A)
NHE ×4
NHE 503(A)
NHE 504(A)
  
Ligand NHE - 2-[N-Cyclohexylamino]ethane sulfonic acid
[N-Cyclohexyltaurine; ches]
Formula: C8H17NO3S
Validation of ligand annotation
Per Residue Validation
Atoms Missing Incorrect Chiral Centres
Residue Dic. Struc. Link Subs. Atoms Rings Planar High C Other
NHE 503(A) 13 13 0 0 Complete Chiral checks - OK
Advanced Analysis
Residue Name Mismatches Count
NHE 503(A) O3: O1|O1: O3 2
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NHE 503(A)

(also representing equivalent ligand NHE 503(B) )
  
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