Browse entries in the PDBbind-CN Database

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Related entries of code: 5auu
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2yakRCSB PDB    PDBbind285aa, >2YAK_1|Chain... at 100%
4txcRCSB PDB    PDBbind304aa, >4TXC_1|Chain... *
5autRCSB PDB    PDBbind293aa, >5AUT_1|Chain... at 97%
5auvRCSB PDB    PDBbind293aa, >5AUV_1|Chain... at 97%
5auwRCSB PDB    PDBbind293aa, >5AUW_1|Chain... at 97%
5auxRCSB PDB    PDBbind293aa, >5AUX_1|Chain... at 97%
5auyRCSB PDB    PDBbind293aa, >5AUY_1|Chain... at 97%
5auzRCSB PDB    PDBbind293aa, >5AUZ_1|Chain... at 97%
5av0RCSB PDB    PDBbind293aa, >5AV0_1|Chain... at 97%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3sz1RCSB PDB    PDBbindLU2
4dewRCSB PDB    PDBbindLU2
4dgnRCSB PDB    PDBbindLU2
4hknRCSB PDB    PDBbindLU2
5ii2RCSB PDB    PDBbindLU2
5ndfRCSB PDB    PDBbindLU2
6m8aRCSB PDB    PDBbindLU2

Entry Information
PDB ID5auu
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameDeath-associated protein kinase 1, DAPK1
Ligand NameLU2
EC.Number E.C.
Resolution 1.7(Å)
Affinity (Kd/Ki/IC50)IC50=21uM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) J.Med.Chem. Vol. 58: pp. 7400-7408
Ligand Properties
Formula C15H10O6
Molecular Weight 286.236
Exact Mass 286.048
No. of atoms 31
No. of bonds 33
Polar Surface Area 111.13
LOGP Value 2.31      (Computed with XLOGP3)
2.28      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
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): P53355  
Entrez Gene IDNCBI Entrez Gene ID: 1612  
ASDInformation of known allosteric effects of PDB entries

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