Browse entries in the PDBbind-CN Database

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Related entries of code: 1ctr
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1k93RCSB PDB    PDBbind144aa, >1K93_2|Chains... at 100%
1lvcRCSB PDB    PDBbind149aa, >1LVC_2|Chains... at 100%
1pk0RCSB PDB    PDBbind147aa, >1PK0_2|Chains... at 100%
1qiwRCSB PDB    PDBbind148aa, >1QIW_1|Chains... at 100%
1s26RCSB PDB    PDBbind148aa, >1S26_2|Chains... at 100%
1xa5RCSB PDB    PDBbind148aa, >1XA5_1|Chain... at 100%
1xfvRCSB PDB    PDBbind149aa, >1XFV_2|Chains... at 99%
1yrtRCSB PDB    PDBbind74aa, >1YRT_2|Chain... at 100%
1yruRCSB PDB    PDBbind74aa, >1YRU_2|Chain... at 100%
2n27RCSB PDB    PDBbind148aa, >2N27_1|Chain... at 100%
2welRCSB PDB    PDBbind150aa, >2WEL_2|Chain... at 99%
3if7RCSB PDB    PDBbind148aa, >3IF7_1|Chain... at 100%
4byfRCSB PDB    PDBbind149aa, >4BYF_2|Chains... at 100%
4dckRCSB PDB    PDBbind149aa, >4DCK_2|Chain... at 100%
4ovnRCSB PDB    PDBbind149aa, >4OVN_1|Chains... at 100%
4r8gRCSB PDB    PDBbind148aa, >4R8G_2|Chains... at 100%
6plmRCSB PDB    PDBbind147aa, >6PLM_2|Chains... at 99%
6o5gRCSB PDB    PDBbind152aa, >6O5G_1|Chain... at 100%
6mudRCSB PDB    PDBbind149aa, >6MUD_1|Chain... at 100%
6mc9RCSB PDB    PDBbind149aa, >6MC9_2|Chain... at 100%
6mbaRCSB PDB    PDBbind149aa, >6MBA_2|Chain... at 100%
6m7hRCSB PDB    PDBbind147aa, >6M7H_1|Chain... at 100%
6k4rRCSB PDB    PDBbind149aa, >6K4R_2|Chains... at 100%
6k4kRCSB PDB    PDBbind149aa, >6K4K_2|Chains... at 100%
6eebRCSB PDB    PDBbind152aa, >6EEB_1|Chain... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID1ctr
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namehuman calmodulin (CaM)
Ligand NameTFP
EC.Number E.C.-.-.-.-
Resolution 2.45(Å)
Affinity (Kd/Ki/IC50)Kd=1uM
Release Year1994
Protein/NA SequenceCheck fasta file
Primary Reference (2008) J. Med. Chem., Vol.51, pp.3081-3093
Ligand Properties
Formula C21H20F3N3S
Molecular Weight 403.464
Exact Mass 403.133
No. of atoms 48
No. of bonds 51
Polar Surface Area 38.4
LOGP Value 4.74      (Computed with XLOGP3)
6.17      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 0
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 3
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): P0DP23  
Entrez Gene IDNCBI Entrez Gene ID: 801  805  808  
ASDInformation of known allosteric effects of PDB entries
 
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