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Related entries of code: 6d4r
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
5j5rRCSB PDB    PDBbind389aa, >5J5R_1|Chain... *
5k4xRCSB PDB    PDBbind389aa, >5K4X_1|Chain... at 100%
5k4zRCSB PDB    PDBbind389aa, >5K4Z_1|Chain... at 100%
5ou1RCSB PDB    PDBbind389aa, >5OU1_1|Chain... at 100%
5ou2RCSB PDB    PDBbind389aa, >5OU2_1|Chain... at 100%
5ou3RCSB PDB    PDBbind389aa, >5OU3_1|Chain... at 100%
6d4wRCSB PDB    PDBbind389aa, >6D4W_1|Chain... at 100%
6d4vRCSB PDB    PDBbind389aa, >6D4V_1|Chain... at 100%
6d4uRCSB PDB    PDBbind389aa, >6D4U_1|Chain... at 100%
6d4tRCSB PDB    PDBbind389aa, >6D4T_1|Chain... at 100%
6d4sRCSB PDB    PDBbind389aa, >6D4S_1|Chain... at 100%
6d4qRCSB PDB    PDBbind389aa, >6D4Q_1|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 ID6d4r
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameInosine-5'-monophosphate dehydrogenase,Inosine-5'-monophosphate dehydrogenase
Ligand NameFWY
EC.Number E.C.1.1.1.205
Resolution 1.34(Å)
Affinity (Kd/Ki/IC50)IC50=1.1uM
Release Year2019
Protein/NA SequenceCheck fasta file
Primary Reference (2019) Eur.J.Med.Chem. Vol. 174: pp. 309-329
Ligand Properties
Formula C20H18N4O5S
Molecular Weight 426.446
Exact Mass 426.100
No. of atoms 48
No. of bonds 51
Polar Surface Area 124.78
LOGP Value 2.01      (Computed with XLOGP3)
3.77      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 4
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): G7CNL4  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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