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Related entries of code: 1k1p
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1aq7RCSB PDB    PDBbind223aa, >1AQ7_1|Chain... at 100%
1aujRCSB PDB    PDBbind223aa, >1AUJ_1|Chain... at 100%
1bjuRCSB PDB    PDBbind223aa, >1BJU_1|Chain... at 100%
1bjvRCSB PDB    PDBbind223aa, >1BJV_1|Chain... at 100%
1btyRCSB PDB    PDBbind229aa, >1BTY_1|Chain... at 100%
1c1rRCSB PDB    PDBbind223aa, >1C1R_1|Chain... at 100%
1c5pRCSB PDB    PDBbind223aa, >1C5P_1|Chain... at 100%
1c5qRCSB PDB    PDBbind223aa, >1C5Q_1|Chain... at 100%
1c5sRCSB PDB    PDBbind223aa, >1C5S_1|Chain... at 100%
1c5tRCSB PDB    PDBbind223aa, >1C5T_1|Chain... at 100%
1ce5RCSB PDB    PDBbind223aa, >1CE5_1|Chain... at 100%
1eb2RCSB PDB    PDBbind223aa, >1EB2_1|Chain... at 100%
1f0tRCSB PDB    PDBbind243aa, >1F0T_1|Chain... *
1f0uRCSB PDB    PDBbind243aa, >1F0U_1|Chain... at 100%
1g36RCSB PDB    PDBbind223aa, >1G36_1|Chain... at 100%
1g3bRCSB PDB    PDBbind228aa, >1G3B_1|Chain... at 100%
1g3cRCSB PDB    PDBbind228aa, >1G3C_1|Chain... at 100%
1g3dRCSB PDB    PDBbind228aa, >1G3D_1|Chain... at 100%
1g3eRCSB PDB    PDBbind228aa, >1G3E_1|Chain... at 100%
1gbtRCSB PDB    PDBbind223aa, >1GBT_1|Chain... at 100%
1ghzRCSB PDB    PDBbind223aa, >1GHZ_1|Chain... at 100%
1gi1RCSB PDB    PDBbind223aa, >1GI1_1|Chain... at 100%
1gi4RCSB PDB    PDBbind223aa, >1GI4_1|Chain... at 100%
1gi6RCSB PDB    PDBbind223aa, >1GI6_1|Chain... at 100%
1gj6RCSB PDB    PDBbind223aa, >1GJ6_1|Chain... at 100%
1jrsRCSB PDB    PDBbind223aa, >1JRS_1|Chain... at 100%
1k1iRCSB PDB    PDBbind223aa, >1K1I_1|Chain... at 100%
1k1jRCSB PDB    PDBbind223aa, >1K1J_1|Chain... at 100%
1k1lRCSB PDB    PDBbind223aa, >1K1L_1|Chain... at 100%
1k1mRCSB PDB    PDBbind223aa, >1K1M_1|Chain... at 100%
1k1nRCSB PDB    PDBbind223aa, >1K1N_1|Chain... at 100%
1k1oRCSB PDB    PDBbind223aa, >1K1O_1|Chain... at 100%
1lqeRCSB PDB    PDBbind243aa, >1LQE_1|Chain... at 100%
1nc6RCSB PDB    PDBbind223aa, >1NC6_1|Chain... at 100%
1o2hRCSB PDB    PDBbind223aa, >1O2H_1|Chain... at 100%
1o2jRCSB PDB    PDBbind223aa, >1O2J_1|Chain... at 100%
1o2kRCSB PDB    PDBbind223aa, >1O2K_1|Chain... at 100%
1o2nRCSB PDB    PDBbind223aa, >1O2N_1|Chain... at 100%
1o2oRCSB PDB    PDBbind223aa, >1O2O_1|Chain... at 100%
1o2pRCSB PDB    PDBbind223aa, >1O2P_1|Chain... at 100%
1o2qRCSB PDB    PDBbind223aa, >1O2Q_1|Chain... at 100%
1o2rRCSB PDB    PDBbind223aa, >1O2R_1|Chain... at 100%
1o2sRCSB PDB    PDBbind223aa, >1O2S_1|Chain... at 100%
1o2tRCSB PDB    PDBbind223aa, >1O2T_1|Chain... at 100%
1o2uRCSB PDB    PDBbind223aa, >1O2U_1|Chain... at 100%
1o2vRCSB PDB    PDBbind223aa, >1O2V_1|Chain... at 100%
1o2wRCSB PDB    PDBbind223aa, >1O2W_1|Chain... at 100%
1o2xRCSB PDB    PDBbind223aa, >1O2X_1|Chain... at 100%
1o2yRCSB PDB    PDBbind223aa, >1O2Y_1|Chain... at 100%
1o2zRCSB PDB    PDBbind223aa, >1O2Z_1|Chain... at 100%
1o30RCSB PDB    PDBbind223aa, >1O30_1|Chain... at 100%
1o32RCSB PDB    PDBbind223aa, >1O32_1|Chain... at 100%
1o33RCSB PDB    PDBbind223aa, >1O33_1|Chain... at 100%
1o34RCSB PDB    PDBbind223aa, >1O34_1|Chain... at 100%
1o35RCSB PDB    PDBbind223aa, >1O35_1|Chain... at 100%
1o36RCSB PDB    PDBbind223aa, >1O36_1|Chain... at 100%
1o37RCSB PDB    PDBbind223aa, >1O37_1|Chain... at 100%
1o38RCSB PDB    PDBbind223aa, >1O38_1|Chain... at 100%
1o39RCSB PDB    PDBbind223aa, >1O39_1|Chain... at 100%
1o3bRCSB PDB    PDBbind223aa, >1O3B_1|Chain... at 100%
1o3cRCSB PDB    PDBbind223aa, >1O3C_1|Chain... at 100%
1o3dRCSB PDB    PDBbind223aa, >1O3D_1|Chain... at 100%
1o3eRCSB PDB    PDBbind223aa, >1O3E_1|Chain... at 100%
1o3fRCSB PDB    PDBbind223aa, >1O3F_1|Chain... at 100%
1o3gRCSB PDB    PDBbind223aa, >1O3G_1|Chain... at 100%
1o3hRCSB PDB    PDBbind223aa, >1O3H_1|Chain... at 100%
1o3iRCSB PDB    PDBbind223aa, >1O3I_1|Chain... at 100%
1o3jRCSB PDB    PDBbind223aa, >1O3J_1|Chain... at 100%
1o3kRCSB PDB    PDBbind223aa, >1O3K_1|Chain... at 100%
1o3lRCSB PDB    PDBbind223aa, >1O3L_1|Chain... at 100%
1ophRCSB PDB    PDBbind243aa, >1OPH_2|Chain... at 99%
1oyqRCSB PDB    PDBbind223aa, >1OYQ_1|Chain... at 100%
1ppcRCSB PDB    PDBbind223aa, >1PPC_1|Chain... at 100%
1pphRCSB PDB    PDBbind223aa, >1PPH_1|Chain... at 100%
1qb1RCSB PDB    PDBbind223aa, >1QB1_1|Chain... at 100%
1qb6RCSB PDB    PDBbind223aa, >1QB6_1|Chain... at 100%
1qb9RCSB PDB    PDBbind223aa, >1QB9_1|Chain... at 100%
1qbnRCSB PDB    PDBbind223aa, >1QBN_1|Chain... at 100%
1qboRCSB PDB    PDBbind223aa, >1QBO_1|Chain... at 100%
1qcpRCSB PDB    PDBbind223aa, >1QCP_1|Chain... at 100%
1ql7RCSB PDB    PDBbind223aa, >1QL7_1|Chain... at 100%
1rxpRCSB PDB    PDBbind223aa, >1RXP_1|Chain... at 100%
1tngRCSB PDB    PDBbind229aa, >1TNG_1|Chain... at 100%
1tnhRCSB PDB    PDBbind229aa, >1TNH_1|Chain... at 100%
1tniRCSB PDB    PDBbind229aa, >1TNI_1|Chain... at 100%
1tnjRCSB PDB    PDBbind229aa, >1TNJ_1|Chain... at 100%
1tnkRCSB PDB    PDBbind229aa, >1TNK_1|Chain... at 100%
1tnlRCSB PDB    PDBbind229aa, >1TNL_1|Chain... at 100%
1tpsRCSB PDB    PDBbind223aa, >1TPS_1|Chain... at 100%
1tx7RCSB PDB    PDBbind223aa, >1TX7_1|Chain... at 100%
1tynRCSB PDB    PDBbind223aa, >1TYN_1|Chain... at 100%
1utnRCSB PDB    PDBbind243aa, >1UTN_1|Chain... at 100%
1utoRCSB PDB    PDBbind243aa, >1UTO_1|Chain... at 100%
1utpRCSB PDB    PDBbind243aa, >1UTP_1|Chain... at 100%
1v2jRCSB PDB    PDBbind223aa, >1V2J_1|Chain... at 98%
1v2kRCSB PDB    PDBbind223aa, >1V2K_1|Chain... at 96%
1v2lRCSB PDB    PDBbind223aa, >1V2L_1|Chain... at 96%
1v2mRCSB PDB    PDBbind223aa, >1V2M_1|Chain... at 96%
1v2nRCSB PDB    PDBbind223aa, >1V2N_1|Chain... at 96%
1v2oRCSB PDB    PDBbind223aa, >1V2O_1|Chain... at 98%
1v2pRCSB PDB    PDBbind223aa, >1V2P_1|Chain... at 98%
1v2qRCSB PDB    PDBbind223aa, >1V2Q_1|Chain... at 98%
1v2rRCSB PDB    PDBbind223aa, >1V2R_1|Chain... at 98%
1v2sRCSB PDB    PDBbind223aa, >1V2S_1|Chain... at 97%
1v2tRCSB PDB    PDBbind223aa, >1V2T_1|Chain... at 97%
1v2uRCSB PDB    PDBbind223aa, >1V2U_1|Chain... at 98%
1v2vRCSB PDB    PDBbind223aa, >1V2V_1|Chain... at 98%
1v2wRCSB PDB    PDBbind223aa, >1V2W_1|Chain... at 98%
1xugRCSB PDB    PDBbind223aa, >1XUG_1|Chain... at 100%
1y3vRCSB PDB    PDBbind223aa, >1Y3V_1|Chain... at 100%
1y3wRCSB PDB    PDBbind223aa, >1Y3W_1|Chain... at 100%
1y3xRCSB PDB    PDBbind223aa, >1Y3X_1|Chain... at 100%
1y3yRCSB PDB    PDBbind223aa, >1Y3Y_1|Chain... at 100%
1yp9RCSB PDB    PDBbind223aa, >1YP9_1|Chain... at 100%
1yyyRCSB PDB    PDBbind223aa, >1YYY_1|Chain... at 100%
1zzzRCSB PDB    PDBbind237aa, >1ZZZ_1|Chain... at 100%
2bzaRCSB PDB    PDBbind223aa, >2BZA_1|Chain... at 100%
2fx6RCSB PDB    PDBbind223aa, >2FX6_1|Chain... at 100%
2j9nRCSB PDB    PDBbind223aa, >2J9N_1|Chain... at 100%
2zdkRCSB PDB    PDBbind223aa, >2ZDK_1|Chain... at 100%
2zdlRCSB PDB    PDBbind223aa, >2ZDL_1|Chain... at 100%
2zdmRCSB PDB    PDBbind223aa, >2ZDM_1|Chain... at 100%
2zdnRCSB PDB    PDBbind223aa, >2ZDN_1|Chain... at 100%
2zfsRCSB PDB    PDBbind223aa, >2ZFS_1|Chain... at 100%
2zftRCSB PDB    PDBbind223aa, >2ZFT_1|Chain... at 100%
2zhdRCSB PDB    PDBbind223aa, >2ZHD_1|Chain... at 100%
2zq1RCSB PDB    PDBbind223aa, >2ZQ1_1|Chain... at 100%
2zq2RCSB PDB    PDBbind223aa, >2ZQ2_1|Chain... at 100%
3aasRCSB PDB    PDBbind223aa, >3AAS_1|Chain... at 100%
3aauRCSB PDB    PDBbind223aa, >3AAU_1|Chain... at 100%
3aavRCSB PDB    PDBbind223aa, >3AAV_1|Chains... at 100%
3atiRCSB PDB    PDBbind223aa, >3ATI_1|Chain... at 100%
3atkRCSB PDB    PDBbind223aa, >3ATK_1|Chain... at 100%
3atlRCSB PDB    PDBbind223aa, >3ATL_1|Chain... at 100%
3atmRCSB PDB    PDBbind223aa, >3ATM_1|Chain... at 100%
3gy2RCSB PDB    PDBbind223aa, >3GY2_1|Chain... at 100%
3gy3RCSB PDB    PDBbind223aa, >3GY3_1|Chain... at 100%
3gy4RCSB PDB    PDBbind223aa, >3GY4_1|Chain... at 100%
3gy7RCSB PDB    PDBbind223aa, >3GY7_1|Chain... at 100%
3ljjRCSB PDB    PDBbind223aa, >3LJJ_1|Chain... at 100%
3ljoRCSB PDB    PDBbind223aa, >3LJO_1|Chain... at 100%
3m35RCSB PDB    PDBbind223aa, >3M35_1|Chain... at 100%
3nk8RCSB PDB    PDBbind223aa, >3NK8_1|Chain... at 100%
3nkkRCSB PDB    PDBbind223aa, >3NKK_1|Chain... at 100%
3rxaRCSB PDB    PDBbind223aa, >3RXA_1|Chain... at 100%
3rxbRCSB PDB    PDBbind223aa, >3RXB_1|Chain... at 100%
3rxdRCSB PDB    PDBbind223aa, >3RXD_1|Chain... at 100%
3rxeRCSB PDB    PDBbind223aa, >3RXE_1|Chain... at 100%
3rxfRCSB PDB    PDBbind223aa, >3RXF_1|Chain... at 100%
3rxgRCSB PDB    PDBbind223aa, >3RXG_1|Chain... at 100%
3rxhRCSB PDB    PDBbind223aa, >3RXH_1|Chain... at 100%
3rxiRCSB PDB    PDBbind223aa, >3RXI_1|Chain... at 100%
3rxjRCSB PDB    PDBbind223aa, >3RXJ_1|Chain... at 100%
3rxkRCSB PDB    PDBbind223aa, >3RXK_1|Chain... at 100%
3rxlRCSB PDB    PDBbind223aa, >3RXL_1|Chain... at 100%
3rxmRCSB PDB    PDBbind223aa, >3RXM_1|Chain... at 100%
3rxoRCSB PDB    PDBbind223aa, >3RXO_1|Chain... at 100%
3rxpRCSB PDB    PDBbind223aa, >3RXP_1|Chain... at 100%
4ab8RCSB PDB    PDBbind223aa, >4AB8_1|Chain... at 100%
4ab9RCSB PDB    PDBbind223aa, >4AB9_1|Chain... at 100%
4abaRCSB PDB    PDBbind223aa, >4ABA_1|Chain... at 100%
4abbRCSB PDB    PDBbind223aa, >4ABB_1|Chain... at 100%
4abdRCSB PDB    PDBbind223aa, >4ABD_1|Chain... at 100%
4abeRCSB PDB    PDBbind223aa, >4ABE_1|Chain... at 100%
4abfRCSB PDB    PDBbind223aa, >4ABF_1|Chain... at 100%
4abgRCSB PDB    PDBbind223aa, >4ABG_1|Chain... at 100%
4abhRCSB PDB    PDBbind223aa, >4ABH_1|Chain... at 100%
5eg4RCSB PDB    PDBbind223aa, >5EG4_1|Chain... at 100%
5lgoRCSB PDB    PDBbind223aa, >5LGO_1|Chain... at 100%
5lh4RCSB PDB    PDBbind223aa, >5LH4_1|Chain... at 100%
5lh8RCSB PDB    PDBbind223aa, >5LH8_1|Chain... at 100%
5mn1RCSB PDB    PDBbind223aa, >5MN1_1|Chain... at 100%
5mnbRCSB PDB    PDBbind223aa, >5MNB_1|Chain... at 100%
5mncRCSB PDB    PDBbind223aa, >5MNC_1|Chain... at 100%
5mngRCSB PDB    PDBbind223aa, >5MNG_1|Chain... at 100%
5mnhRCSB PDB    PDBbind223aa, >5MNH_1|Chain... at 100%
5mnnRCSB PDB    PDBbind223aa, >5MNN_1|Chain... at 100%
5mnoRCSB PDB    PDBbind223aa, >5MNO_1|Chain... at 100%
5mnxRCSB PDB    PDBbind223aa, >5MNX_1|Chain... at 100%
5mnyRCSB PDB    PDBbind223aa, >5MNY_1|Chain... at 100%
5mo0RCSB PDB    PDBbind223aa, >5MO0_1|Chain... at 100%
5mo2RCSB PDB    PDBbind223aa, >5MO2_1|Chain... at 100%
5monRCSB PDB    PDBbind223aa, >5MON_1|Chain... at 100%
5mooRCSB PDB    PDBbind223aa, >5MOO_1|Chain... at 100%
5moqRCSB PDB    PDBbind223aa, >5MOQ_1|Chain... at 100%
5mosRCSB PDB    PDBbind223aa, >5MOS_1|Chain... at 100%
6bfpRCSB PDB    PDBbind223aa, >6BFP_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1k22RCSB PDB    PDBbindMEL
4bahRCSB PDB    PDBbindMEL

Entry Information
PDB ID1k1p
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namebovine trypsin
Ligand NameMEL
EC.Number E.C.3.4.21.4
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)IC50=11.9nM
Release Year2001
Protein/NA SequenceCheck fasta file
Primary Reference (2003) Bioorg. Med. Chem. Lett., Vol.13, pp.2029-2033
Ligand Properties
Formula C22H33N5O4
Molecular Weight 431.529
Exact Mass 431.253
No. of atoms 64
No. of bonds 66
Polar Surface Area 154.93
LOGP Value 1.72      (Computed with XLOGP3)
-1.01      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 9
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): P00760  
Entrez Gene IDNCBI Entrez Gene ID: 615026  780933  
ASDInformation of known allosteric effects of PDB entries

 
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