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Related entries of code: 1nmk
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1ak4RCSB PDB    PDBbind165aa, >1AK4:A|PDBID|CHAIN|... at 100%
1w8lRCSB PDB    PDBbind165aa, >1W8L:A|PDBID|CHAIN|... at 100%
1w8mRCSB PDB    PDBbind165aa, >1W8M:A|PDBID|CHAIN|... at 100%
1yndRCSB PDB    PDBbind165aa, >1YND:B|PDBID|CHAIN|... at 100%
2ms4RCSB PDB    PDBbind165aa, >2MS4:A|PDBID|CHAIN|... at 100%
2x2dRCSB PDB    PDBbind165aa, >2X2D:C|PDBID|CHAIN|... at 100%
4dgbRCSB PDB    PDBbind165aa, >4DGB:A|PDBID|CHAIN|... at 98%
4dgeRCSB PDB    PDBbind165aa, >4DGE:B|PDBID|CHAIN|... at 98%
5ludRCSB PDB    PDBbind165aa, >5LUD:A|PDBID|CHAIN|... at 100%
5t9uRCSB PDB    PDBbind164aa, >5T9U:D|PDBID|CHAIN|... at 100%
5t9wRCSB PDB    PDBbind164aa, >5T9W:A|PDBID|CHAIN|... at 100%
5t9zRCSB PDB    PDBbind163aa, >5T9Z:A|PDBID|CHAIN|... at 100%
5ta2RCSB PDB    PDBbind163aa, >5TA2:A|PDBID|CHAIN|... at 100%
5ta4RCSB PDB    PDBbind164aa, >5TA4:A|PDBID|CHAIN|... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1nmk
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namepeptidyl-prolyl cis-trans isomerase a
Ligand NameSFM
EC.Number E.C.
Resolution 2.1(Å)
Affinity (Kd/Ki/IC50)IC50=5.7nM
Release Year2003
Protein/NA SequenceCheck fasta file
Primary ReferenceJ.Am.Chem.Soc. v125 pp. 3849-59, 2003
Ligand Properties
Formula C39H57N4O10
Molecular Weight 741.891
Exact Mass 741.407
No. of atoms 110
No. of bonds 112
Polar Surface Area 219.41
LOGP Value 2.89      (Computed with XLOGP3)
2.90      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 9
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 14
No. of Rings: 3
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P62937  
Entrez Gene IDNCBI Entrez Gene ID: 5478  
ASDInformation of known allosteric effects of PDB entries

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