Browse entries in the PDBbind-CN Database

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Related entries of code: 1fd7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1eefRCSB PDB    PDBbind103aa, >1EEF_1|Chains... *
1efiRCSB PDB    PDBbind103aa, >1EFI_1|Chains... at 100%
1jqyRCSB PDB    PDBbind103aa, >1JQY_1|Chains... at 100%
1lt5RCSB PDB    PDBbind103aa, >1LT5_1|Chains... at 100%
1lt6RCSB PDB    PDBbind103aa, >1LT6_1|Chains... at 100%
1pziRCSB PDB    PDBbind103aa, >1PZI_1|Chains... at 100%
1tetRCSB PDB    PDBbind15aa, >1TET_3|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 ID1fd7
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameheat-labile enterotoxin b chain
Ligand NameAI1
EC.Number E.C.-.-.-.-
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)IC50=14mM
Release Year2000
Protein/NA SequenceCheck fasta file
Primary Reference Acta Crystallogr., Sect.D v57 pp. 201-12, 2001
Ligand Properties
Formula C20H23NO7
Molecular Weight 389.399
Exact Mass 389.147
No. of atoms 51
No. of bonds 53
Polar Surface Area 128.48
LOGP Value 0.53      (Computed with XLOGP3)
0.19      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 8
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): P32890  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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