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Solution NMR structures of BRD4 ET domain in complex with NSD3_1 peptide
Authors
Zeng, L., ZHOU, M.
Assembly
BRD4 ET with NSD3 1
Entity
1. BRD4 ET with NSD3 1, entity 1 (polymer, Thiol state: all free), 83 monomers, 9726.987 Da Detail

SEEEDKCKPM SYEEKRQLSL DINKLPGEKL GRVVHIIQSR EPSLKNSNPD EIEIDFETLK PSTLRELERY VTSCLRKKRK PQA


2. BRD4 ET with NSD3 1, entity 2 (polymer, Thiol state: all free), 12 monomers, 1428.714 Da Detail

EIKLKITKTI QN


Total weight
11155.701 Da
Max. entity weight
9726.987 Da
Source organism
Homo sapiens
Exptl. method
solution NMR
Refine. method
torsion angle dynamics, simulated annealing
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 100.0 %, Completeness: 83.9 %, Completeness (bb): 80.6 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All83.9 % (987 of 1177)89.3 % (565 of 633)76.3 % (341 of 447)83.5 % (81 of 97)
Backbone80.6 % (450 of 558)97.8 % (182 of 186)67.8 % (192 of 283)85.4 % (76 of 89)
Sidechain88.1 % (627 of 712)85.7 % (383 of 447)93.0 % (239 of 257)62.5 % (5 of 8)
Aromatic100.0 % (30 of 30)100.0 % (15 of 15)100.0 % (15 of 15)
Methyl93.8 % (90 of 96)97.9 % (47 of 48)89.6 % (43 of 48)

1. entity 1

SEEEDKCKPM SYEEKRQLSL DINKLPGEKL GRVVHIIQSR EPSLKNSNPD EIEIDFETLK PSTLRELERY VTSCLRKKRK PQA

2. entity 2

EIKLKITKTI QN

Sample #1

Solvent system 100% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5


#NameIsotope labelingTypeConcentration
1entity_1natural abundanceprotein0.0 ~ 0.0 mM
2entity_2natural abundanceprotein0.0 ~ 0.0 mM
3sodium phosphatenatural abundancebuffer10 mM
4sodium chloridenatural abundancesalt100 mM
5DTT[U-100% 2H]2 mM
6D2O[U-2H]solvent100 %
Sample #2

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6.5


#NameIsotope labelingTypeConcentration
7entity_1natural abundanceprotein0.0 ~ 0.0 mM
8entity_2natural abundanceprotein0.0 ~ 0.0 mM
9sodium phosphatenatural abundancebuffer10 mM
10sodium chloridenatural abundancesalt100 mM
11DTT[U-100% 2H]2 mM
12H2Onatural abundancesolvent90 %
13D2O[U-2H]solvent10 %

Protein Blocks Logo
Calculated from 20 models in PDB: 2NCZ, Strand ID: A, B Detail


Release date
2016-06-29
Citation
Structural Mechanism of Transcriptional Regulator NSD3 Recognition by the ET Domain of BRD4
Zhang, Q., Zeng, L., Shen, C., Ju, Y., Konuma, T., Zhao, C., Vakoc, C.R., ZHOU, M.
Structure (2016), 24, 1201-1208, PubMed 27291650 , DOI 10.1016/j.str.2016.04.019 ,
Entries sharing articles BMRB: 2 entries Detail
  BMRB: 26042 released on 2016-06-29
    Title Solution NMR structures of BRD4 ET domain with LANA peptide
  BMRB: 26043 released on 2016-06-29
    Title Solution NMR structures of BRD4 ET domain in complex with NSD3_3 peptide
Related entities 1. BRD4 ET with NSD3 1, entity 1, : 5 : 80 entities Detail
Related entities 2. BRD4 ET with NSD3 1, entity 2, : 3 entities Detail
Interaction partners 1. BRD4 ET with NSD3 1, entity 1, : 42 interactors Detail
Experiments performed 8 experiments Detail
nullKeywords BET, BRD4, ET, LANA, NSD3