PDBsum entry 5hrx

Transcription

PDB id: 5hrx

Contents

Protein chains

110 a.a.

Ligands

EDO ×2

64F ×2

Waters ×75

PDB id:

5hrx

Name:

Transcription

Title:

Crystal structure of the fifth bromodomain of human pb1 in complex with 1-butylisochromeno[3,4-c]pyrazol-5(2h)-one) compound

Structure:

Protein polybromo-1. Chain: a, b. Fragment: unp residues 613-734. Synonym: hpb1,brg1-associated factor 180,baf180,polybromo-1d,pb1 fifth bromodomain. Engineered: yes

Source:

Homo sapiens. Human. Organism_taxid: 9606. Gene: pbrm1, baf180, pb1. Expressed in: escherichia coli. Expression_system_taxid: 562

Resolution:

1.73Å R-factor: 0.216 R-free: 0.254

Authors:

C.Tallant,V.Myrianthopoulos,N.Gaboriaud-Kolar,J.A.Newman,S.Picaud, F.Von Delft,C.H.Arrowsmith,A.M.Edwards,C.Bountra,E.Mikros,S.Knapp

Key ref:

V.Myrianthopoulos et al. (2016). Discovery and Optimization of a Selective Ligand for the Switch/Sucrose Nonfermenting-Related Bromodomains of Polybromo Protein-1 by the Use of Virtual Screening and Hydration Analysis. J Med Chem, 59, 8787-8803. PubMed id: 27617704 DOI: 10.1021/acs.jmedchem.6b00355

Date:

24-Jan-16 Release date: 12-Oct-16

Protein chains

Q86U86  (PB1_HUMAN) -  Protein polybromo-1 from Homo sapiens

Seq: 1689 a.a.

Struc: 110 a.a.

Enzyme reactions

• Enzyme class: E.C.?

DOI no: 10.1021/acs.jmedchem.6b00355

J Med Chem 59:8787-8803 (2016)

PubMed id: 27617704

Discovery and Optimization of a Selective Ligand for the Switch/Sucrose Nonfermenting-Related Bromodomains of Polybromo Protein-1 by the Use of Virtual Screening and Hydration Analysis.

V.Myrianthopoulos, N.Gaboriaud-Kolar, C.Tallant, M.L.Hall, S.Grigoriou, P.M.Brownlee, O.Fedorov, C.Rogers, D.Heidenreich, M.Wanior, N.Drosos, N.Mexia, P.Savitsky, T.Bagratuni, E.Kastritis, E.Terpos, P.Filippakopoulos, S.Müller, A.L.Skaltsounis, J.A.Downs, S.Knapp, E.Mikros.

ABSTRACT

No abstract given.