Related entries of code: 3mxf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2yelRCSB PDB    PDBbind127aa, >2yel_A... at 100%
3jvkRCSB PDB    PDBbind131aa, >3jvk_A... at 96%
3mukRCSB PDB    PDBbind131aa, >3muk_A... at 96%
3p5oRCSB PDB    PDBbind127aa, >3p5o_A... at 100%
3u5jRCSB PDB    PDBbind127aa, >3u5j_A... at 100%
3u5lRCSB PDB    PDBbind127aa, >3u5l_A... at 100%
3zyuRCSB PDB    PDBbind127aa, >3zyu_B... at 100%
4bjxRCSB PDB    PDBbind153aa, >4bjx_A... *
4bw1RCSB PDB    PDBbind127aa, >4bw1_A... at 100%
4bw2RCSB PDB    PDBbind127aa, >4bw2_A... at 100%
4bw3RCSB PDB    PDBbind127aa, >4bw3_A... at 100%
4bw4RCSB PDB    PDBbind127aa, >4bw4_A... at 100%
4c66RCSB PDB    PDBbind126aa, >4c66_A... at 100%
4cflRCSB PDB    PDBbind127aa, >4cfl_A... at 100%
4cl9RCSB PDB    PDBbind127aa, >4cl9_A... at 100%
4clbRCSB PDB    PDBbind127aa, >4clb_A... at 100%
4e96RCSB PDB    PDBbind127aa, >4e96_A... at 100%
4f3iRCSB PDB    PDBbind127aa, >4f3i_A... at 100%
4hbvRCSB PDB    PDBbind127aa, >4hbv_A... at 100%
4hbwRCSB PDB    PDBbind127aa, >4hbw_A... at 99%
4hbxRCSB PDB    PDBbind127aa, >4hbx_A... at 100%
4hbyRCSB PDB    PDBbind127aa, >4hby_A... at 100%
4hxlRCSB PDB    PDBbind125aa, >4hxl_A... at 100%
4hxmRCSB PDB    PDBbind124aa, >4hxm_A... at 100%
4hxrRCSB PDB    PDBbind125aa, >4hxr_A... at 100%
4hxsRCSB PDB    PDBbind124aa, >4hxs_A... at 100%
4j0rRCSB PDB    PDBbind127aa, >4j0r_A... at 100%
4j0sRCSB PDB    PDBbind127aa, >4j0s_A... at 100%
4j3iRCSB PDB    PDBbind127aa, >4j3i_A... at 100%
4lysRCSB PDB    PDBbind126aa, >4lys_A... at 100%
4lywRCSB PDB    PDBbind127aa, >4lyw_A... at 99%
4lzrRCSB PDB    PDBbind127aa, >4lzr_A... at 96%
4lzsRCSB PDB    PDBbind127aa, >4lzs_A... at 100%
4menRCSB PDB    PDBbind127aa, >4men_A... at 100%
4meoRCSB PDB    PDBbind127aa, >4meo_A... at 100%
4mepRCSB PDB    PDBbind127aa, >4mep_A... at 100%
4meqRCSB PDB    PDBbind127aa, >4meq_A... at 100%
4mr3RCSB PDB    PDBbind127aa, >4mr3_A... at 100%
4mr4RCSB PDB    PDBbind127aa, >4mr4_A... at 100%
4nucRCSB PDB    PDBbind127aa, >4nuc_A... at 100%
4nudRCSB PDB    PDBbind127aa, >4nud_A... at 100%
4nueRCSB PDB    PDBbind127aa, >4nue_A... at 100%
4o70RCSB PDB    PDBbind127aa, >4o70_B... at 100%
4o71RCSB PDB    PDBbind127aa, >4o71_B... at 100%
4o72RCSB PDB    PDBbind127aa, >4o72_A... at 100%
4o74RCSB PDB    PDBbind127aa, >4o74_B... at 100%
4o75RCSB PDB    PDBbind127aa, >4o75_A... at 100%
4o76RCSB PDB    PDBbind127aa, >4o76_D... at 100%
4o77RCSB PDB    PDBbind127aa, >4o77_B... at 100%
4o78RCSB PDB    PDBbind127aa, >4o78_A... at 100%
4o7aRCSB PDB    PDBbind127aa, >4o7a_A... at 100%
4o7bRCSB PDB    PDBbind127aa, >4o7b_A... at 100%
4o7cRCSB PDB    PDBbind127aa, >4o7c_A... at 100%
4o7eRCSB PDB    PDBbind127aa, >4o7e_B... at 100%
4o7fRCSB PDB    PDBbind127aa, >4o7f_B... at 100%
4ogiRCSB PDB    PDBbind127aa, >4ogi_B... at 100%
4ogjRCSB PDB    PDBbind127aa, >4ogj_B... at 100%
4pceRCSB PDB    PDBbind127aa, >4pce_A... at 100%
4pciRCSB PDB    PDBbind127aa, >4pci_A... at 100%
4ps5RCSB PDB    PDBbind127aa, >4ps5_B... at 100%
4qb3RCSB PDB    PDBbind127aa, >4qb3_A... at 100%
4qr3RCSB PDB    PDBbind125aa, >4qr3_A... at 100%
4qr4RCSB PDB    PDBbind125aa, >4qr4_A... at 100%
4qr5RCSB PDB    PDBbind125aa, >4qr5_A... at 100%
4qzsRCSB PDB    PDBbind127aa, >4qzs_A... at 100%
4uixRCSB PDB    PDBbind127aa, >4uix_C... at 99%
4uiyRCSB PDB    PDBbind127aa, >4uiy_A... at 100%
4uizRCSB PDB    PDBbind127aa, >4uiz_A... at 100%
5acyRCSB PDB    PDBbind127aa, >5acy_B... at 100%
4uydRCSB PDB    PDBbind153aa, >4uyd_A... at 90%
4wivRCSB PDB    PDBbind127aa, >4wiv_A... at 100%
4xy9RCSB PDB    PDBbind127aa, >4xy9_A... at 100%
4xyaRCSB PDB    PDBbind127aa, >4xya_A... at 100%
4z1qRCSB PDB    PDBbind127aa, >4z1q_B... at 98%
4z1sRCSB PDB    PDBbind126aa, >4z1s_B... at 98%
5a5sRCSB PDB    PDBbind127aa, >5a5s_A... at 99%
5a85RCSB PDB    PDBbind127aa, >5a85_A... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4flpRCSB PDB    PDBbindJQ1
4qzsRCSB PDB    PDBbindJQ1

Entry Information
PDB ID3mxf
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameBromodomain-containing protein 4(humand BRD4(1))
Ligand NameJQ1
EC.Number E.C.-.-.-.-
Resolution 1.6(Å)
Affinity (Kd/Ki/IC50)Kd=49nM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary ReferenceNature. 468: 1067-1073
Ligand Properties
Formula C23H25ClN4O2S
Molecular Weight 456.988
Exact Mass 456.139
No. of atoms 56
No. of bonds 59
Polar Surface Area 97.61
LOGP Value 4.85      (Computed with XLOGP3)
4.97      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
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
ASDInformation of known allosteric effects of PDB entries

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