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Related entries of code: 1u33
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1u2yRCSB PDB    PDBbind496aa, >1U2Y_1|Chain... *
1xd0RCSB PDB    PDBbind496aa, >1XD0_1|Chain... at 100%
3oldRCSB PDB    PDBbind496aa, >3OLD_1|Chain... at 99%
3oleRCSB PDB    PDBbind496aa, >3OLE_1|Chain... at 99%
3olgRCSB PDB    PDBbind496aa, >3OLG_1|Chain... at 99%
3oliRCSB PDB    PDBbind496aa, >3OLI_1|Chain... at 99%
4gqqRCSB PDB    PDBbind496aa, >4GQQ_1|Chain... at 100%
4gqrRCSB PDB    PDBbind496aa, >4GQR_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 ID1u33
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namealpha-amylase
Ligand NameLM2
EC.Number E.C.
Resolution 1.95(Å)
Affinity (Kd/Ki/IC50)Ki=25uM
Release Year2004
Protein/NA SequenceCheck fasta file
Primary Reference J.Biol.Chem. v279 pp. 48282-91, 2004
Ligand Properties
Formula C19H34N2O15
Molecular Weight 530.478
Exact Mass 530.196
No. of atoms 70
No. of bonds 72
Polar Surface Area 272.84
LOGP Value -6.10      (Computed with XLOGP3)
-6.55      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 11
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 18
No. of Nitrogen and Oxygen Atoms: 17
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): P04746  
Entrez Gene IDNCBI Entrez Gene ID: 279  
ASDInformation of known allosteric effects of PDB entries

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