Browse entries in the PDBbind-CN Database

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Related entries of code: 1f8a
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2itkRCSB PDB    PDBbind167aa, >2ITK_1|Chain... at 99%
2xp3RCSB PDB    PDBbind167aa, >2XP3_1|Chain... at 99%
2xp4RCSB PDB    PDBbind167aa, >2XP4_1|Chain... at 99%
2xp5RCSB PDB    PDBbind167aa, >2XP5_1|Chain... at 99%
2xp6RCSB PDB    PDBbind167aa, >2XP6_1|Chain... at 98%
2xp7RCSB PDB    PDBbind167aa, >2XP7_1|Chain... at 99%
2xp8RCSB PDB    PDBbind167aa, >2XP8_1|Chain... at 99%
2xpaRCSB PDB    PDBbind167aa, >2XPA_1|Chain... at 99%
2xpbRCSB PDB    PDBbind167aa, >2XPB_1|Chain... at 99%
3i6cRCSB PDB    PDBbind123aa, >3I6C_1|Chains... at 95%
3ikdRCSB PDB    PDBbind123aa, >3IKD_1|Chains... at 95%
3ikgRCSB PDB    PDBbind123aa, >3IKG_1|Chains... at 95%
3jyjRCSB PDB    PDBbind123aa, >3JYJ_1|Chains... at 95%
3kabRCSB PDB    PDBbind167aa, >3KAB_1|Chain... at 99%
3kacRCSB PDB    PDBbind123aa, >3KAC_1|Chains... at 96%
3kadRCSB PDB    PDBbind167aa, >3KAD_1|Chain... at 98%
3kafRCSB PDB    PDBbind167aa, >3KAF_1|Chain... at 98%
3kagRCSB PDB    PDBbind167aa, >3KAG_1|Chain... at 99%
3kahRCSB PDB    PDBbind167aa, >3KAH_1|Chain... at 99%
3kaiRCSB PDB    PDBbind167aa, >3KAI_1|Chain... at 99%
3kceRCSB PDB    PDBbind167aa, >3KCE_1|Chain... at 99%
3ntpRCSB PDB    PDBbind167aa, >3NTP_1|Chain... at 99%
3odkRCSB PDB    PDBbind167aa, >3ODK_1|Chain... at 99%
3oobRCSB PDB    PDBbind163aa, >3OOB_1|Chain... at 99%
3tc5RCSB PDB    PDBbind166aa, >3TC5_1|Chain... at 97%
4tyoRCSB PDB    PDBbind123aa, >4TYO_1|Chains... at 95%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1bm2RCSB PDB    PDBbind7-mer
1bzhRCSB PDB    PDBbind7-mer
1ekbRCSB PDB    PDBbind7-mer
1evhRCSB PDB    PDBbind7-mer
1fhrRCSB PDB    PDBbind7-mer
1fknRCSB PDB    PDBbind7-mer
1j4kRCSB PDB    PDBbind7-mer
1jojRCSB PDB    PDBbind7-mer
1m4hRCSB PDB    PDBbind7-mer
1n7tRCSB PDB    PDBbind7-mer
1nltRCSB PDB    PDBbind7-mer
1oh4RCSB PDB    PDBbind7-mer
1okwRCSB PDB    PDBbind7-mer
1pipRCSB PDB    PDBbind7-mer
1py1RCSB PDB    PDBbind7-mer
1q5lRCSB PDB    PDBbind7-mer
1qscRCSB PDB    PDBbind7-mer
1rzxRCSB PDB    PDBbind7-mer
1slgRCSB PDB    PDBbind7-mer
1stsRCSB PDB    PDBbind7-mer
1tzeRCSB PDB    PDBbind7-mer
1umwRCSB PDB    PDBbind7-mer
1vwnRCSB PDB    PDBbind7-mer
2er6RCSB PDB    PDBbind7-mer
2joaRCSB PDB    PDBbind7-mer
2l7uRCSB PDB    PDBbind7-mer
2mipRCSB PDB    PDBbind7-mer
2nmbRCSB PDB    PDBbind7-mer
2pemRCSB PDB    PDBbind7-mer
2pv1RCSB PDB    PDBbind7-mer
2q3zRCSB PDB    PDBbind7-mer
2w6uRCSB PDB    PDBbind7-mer
2w78RCSB PDB    PDBbind7-mer
2xqqRCSB PDB    PDBbind7-mer
2zlfRCSB PDB    PDBbind7-mer
3ddaRCSB PDB    PDBbind7-mer
3ddbRCSB PDB    PDBbind7-mer
3fvhRCSB PDB    PDBbind7-mer
3iflRCSB PDB    PDBbind7-mer
3ifoRCSB PDB    PDBbind7-mer
3ifpRCSB PDB    PDBbind7-mer
3l81RCSB PDB    PDBbind7-mer
3nziRCSB PDB    PDBbind7-mer
3oleRCSB PDB    PDBbind7-mer
3olgRCSB PDB    PDBbind7-mer
3oliRCSB PDB    PDBbind7-mer
3rq7RCSB PDB    PDBbind7-mer
3rulRCSB PDB    PDBbind7-mer
3rumRCSB PDB    PDBbind7-mer
3runRCSB PDB    PDBbind7-mer
3stjRCSB PDB    PDBbind7-mer
3t6rRCSB PDB    PDBbind7-mer
3upvRCSB PDB    PDBbind7-mer
3uqrRCSB PDB    PDBbind7-mer
3vb6RCSB PDB    PDBbind7-mer
3vfjRCSB PDB    PDBbind7-mer
3wdcRCSB PDB    PDBbind7-mer
3wddRCSB PDB    PDBbind7-mer
3wdeRCSB PDB    PDBbind7-mer
4aifRCSB PDB    PDBbind7-mer
4dfwRCSB PDB    PDBbind7-mer
4dvfRCSB PDB    PDBbind7-mer
4eqfRCSB PDB    PDBbind7-mer
4ezwRCSB PDB    PDBbind7-mer
4ezxRCSB PDB    PDBbind7-mer
4ezyRCSB PDB    PDBbind7-mer
4ezzRCSB PDB    PDBbind7-mer
4fbxRCSB PDB    PDBbind7-mer
4fgxRCSB PDB    PDBbind7-mer
4gneRCSB PDB    PDBbind7-mer
4gplRCSB PDB    PDBbind7-mer
4igkRCSB PDB    PDBbind7-mer
4j73RCSB PDB    PDBbind7-mer
4lp9RCSB PDB    PDBbind7-mer
4mn3RCSB PDB    PDBbind7-mer
4o6wRCSB PDB    PDBbind7-mer
4onfRCSB PDB    PDBbind7-mer
4tkyRCSB PDB    PDBbind7-mer
4u0gRCSB PDB    PDBbind7-mer
6isoRCSB PDB    PDBbind7-mer
4x3iRCSB PDB    PDBbind7-mer
4x3kRCSB PDB    PDBbind7-mer
4y32RCSB PDB    PDBbind7-mer
4y3bRCSB PDB    PDBbind7-mer
5cs2RCSB PDB    PDBbind7-mer
5hjdRCSB PDB    PDBbind7-mer
5j5xRCSB PDB    PDBbind7-mer
5lynRCSB PDB    PDBbind7-mer
5m63RCSB PDB    PDBbind7-mer
5n7gRCSB PDB    PDBbind7-mer
5ovcRCSB PDB    PDBbind7-mer
5ovpRCSB PDB    PDBbind7-mer
5ovvRCSB PDB    PDBbind7-mer
5oydRCSB PDB    PDBbind7-mer
5w38RCSB PDB    PDBbind7-mer
5wxgRCSB PDB    PDBbind7-mer
5wxhRCSB PDB    PDBbind7-mer
5xo2RCSB PDB    PDBbind7-mer
5xofRCSB PDB    PDBbind7-mer
5y20RCSB PDB    PDBbind7-mer
5yyfRCSB PDB    PDBbind7-mer
6b67RCSB PDB    PDBbind7-mer
6cenRCSB PDB    PDBbind7-mer
6do3RCSB PDB    PDBbind7-mer
6exjRCSB PDB    PDBbind7-mer
6mnfRCSB PDB    PDBbind7-mer
7kmeRCSB PDB    PDBbind7-mer
8hvpRCSB PDB    PDBbind7-mer
6pkaRCSB PDB    PDBbind7-mer
6p3wRCSB PDB    PDBbind7-mer
6oxlRCSB PDB    PDBbind7-mer
6om4RCSB PDB    PDBbind7-mer
6n3eRCSB PDB    PDBbind7-mer
6mqmRCSB PDB    PDBbind7-mer
6hldRCSB PDB    PDBbind7-mer
6gf3RCSB PDB    PDBbind7-mer
6frjRCSB PDB    PDBbind7-mer
6cn8RCSB PDB    PDBbind7-mer
5n7bRCSB PDB    PDBbind7-mer
6dn5RCSB PDB    PDBbind7-mer
Entry Information
PDB ID1f8a
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namepeptidyl-prolyl cis-trans isomerase
Ligand Name7-mer
EC.Number E.C.5.2.1.8
Resolution 1.84(Å)
Affinity (Kd/Ki/IC50)Kd=10uM
Release Year2000
Protein/NA SequenceCheck fasta file
Primary Reference Nat.Struct.Biol. v7 pp. 639-43, 2000
Ligand Properties
Formula C32H52N7O19P2
Molecular Weight 900.738
Exact Mass 900.279
No. of atoms 112
No. of bonds 114
Polar Surface Area 449.67
LOGP Value -8.08      (Computed with XLOGP3)
-5.29      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 17
No. of Rotatable Bonds: 27
No. of Nitrogen and Oxygen Atoms: 26
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): Q13526  
Entrez Gene IDNCBI Entrez Gene ID: 5300  
ASDInformation of known allosteric effects of PDB entries
 
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