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Related entries of code: 1uml
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1ndvRCSB PDB    PDBbind356aa, >1NDV_1|Chain... at 99%
1ndwRCSB PDB    PDBbind356aa, >1NDW_1|Chain... at 99%
1ndyRCSB PDB    PDBbind356aa, >1NDY_1|Chain... at 99%
1ndzRCSB PDB    PDBbind356aa, >1NDZ_1|Chain... at 99%
1o5rRCSB PDB    PDBbind356aa, >1O5R_1|Chain... at 99%
1qxlRCSB PDB    PDBbind356aa, >1QXL_1|Chain... at 100%
1v79RCSB PDB    PDBbind356aa, >1V79_1|Chain... at 99%
1v7aRCSB PDB    PDBbind356aa, >1V7A_1|Chain... at 99%
1wxzRCSB PDB    PDBbind356aa, >1WXZ_1|Chain... at 99%
2bgnRCSB PDB    PDBbind363aa, >2BGN_2|Chains... *
2e1wRCSB PDB    PDBbind356aa, >2E1W_1|Chain... at 99%
2z7gRCSB PDB    PDBbind356aa, >2Z7G_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 ID1uml
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameadenosine deaminase
Ligand NameFR4
EC.Number E.C.3.5.4.4
Resolution 2.5(Å)
Affinity (Kd/Ki/IC50)Ki=30nM
Release Year2004
Protein/NA SequenceCheck fasta file
Primary Reference J.Med.Chem. v47 pp. 3730-43, 2004
Ligand Properties
Formula C25H27N5O3
Molecular Weight 445.514
Exact Mass 445.211
No. of atoms 60
No. of bonds 63
Polar Surface Area 115.17
LOGP Value 1.64      (Computed with XLOGP3)
3.91      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 8
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): P56658  
Entrez Gene IDNCBI Entrez Gene ID: 280712  
ASDInformation of known allosteric effects of PDB entries

 
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