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Related entries of code: 4zz1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1njsRCSB PDB    PDBbind209aa, >1NJS_1|Chains... at 100%
4ew2RCSB PDB    PDBbind209aa, >4EW2_1|Chain... at 100%
4ew3RCSB PDB    PDBbind209aa, >4EW3_1|Chain... at 100%
4zytRCSB PDB    PDBbind210aa, >4ZYT_1|Chain... *
4zyuRCSB PDB    PDBbind210aa, >4ZYU_1|Chain... at 100%
4zyvRCSB PDB    PDBbind210aa, >4ZYV_1|Chain... at 100%
4zywRCSB PDB    PDBbind210aa, >4ZYW_1|Chain... at 100%
4zyxRCSB PDB    PDBbind210aa, >4ZYX_1|Chain... at 100%
4zyyRCSB PDB    PDBbind210aa, >4ZYY_1|Chain... at 100%
4zyzRCSB PDB    PDBbind210aa, >4ZYZ_1|Chain... at 100%
4zz0RCSB PDB    PDBbind210aa, >4ZZ0_1|Chain... at 100%
4zz2RCSB PDB    PDBbind210aa, >4ZZ2_1|Chain... at 100%
4zz3RCSB PDB    PDBbind210aa, >4ZZ3_1|Chain... at 100%
5j9fRCSB PDB    PDBbind210aa, >5J9F_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID4zz1
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namehuman glycinamide ribonucleotide formyltransferase (GARFTase)
Ligand Name3YF
EC.Number E.C.2.1.2.2
Resolution 1.35(Å)
Affinity (Kd/Ki/IC50)Ki=13nM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) J.Med.Chem. Vol. 58: pp. 6938-6959
Ligand Properties
Formula C19H22N5O6S
Molecular Weight 448.473
Exact Mass 448.129
No. of atoms 53
No. of bonds 55
Polar Surface Area 220.75
LOGP Value 4.24      (Computed with XLOGP3)
1.51      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 11
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): P22102  
Entrez Gene IDNCBI Entrez Gene ID: 2618  
ASDInformation of known allosteric effects of PDB entries
 
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