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NMR structure of the ubiquitin associated (UBA) domain of p62 (SQSTM1) in complex with ubiquitin. RDC refined
Authors
Long, J.E., Layfield, R., Searle, M.S.
Assembly
P62 UBA in complex with ubiquitin
Entity
1. P62 UBA (polymer, Thiol state: not present), 52 monomers, 5739.363 Da Detail

GSPPEADPRL IESLSQMLSM GFSDEGGWLT RLLQTKNYDI GAALDTIQYS KH


2. ubiquitin (polymer, Thiol state: not present), 76 monomers, 8556.668 Da Detail

MQIFVKTLTG KTITLEVESS DTIDNVKSKI QDKEGIPPDQ QRLIFAGKQL EDGRTLSDYN IQKESTLHLV LRLRGG


Total weight
14296.031 Da
Max. entity weight
8556.668 Da
Source organism
Homo sapiens
Exptl. method
solution NMR
Refine. method
simulated annealing
Data set
assigned_chemical_shifts, RDCs
Chem. Shift Complete
Sequence coverage: 44.5 %, Completeness: 39.5 %, Completeness (bb): 42.1 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All39.5 % (591 of 1495)37.9 % (296 of 782)41.4 % (239 of 577)41.2 % (56 of 136)
Backbone42.1 % (319 of 758)41.6 % (109 of 262)42.6 % (159 of 373)41.5 % (51 of 123)
Sidechain37.7 % (322 of 854)36.0 % (187 of 520)40.5 % (130 of 321)38.5 % (5 of 13)
Aromatic56.8 % (42 of 74)56.8 % (21 of 37)55.6 % (20 of 36)100.0 % (1 of 1)
Methyl35.1 % (52 of 148)35.1 % (26 of 74)35.1 % (26 of 74)

1. P62 UBA

GSPPEADPRL IESLSQMLSM GFSDEGGWLT RLLQTKNYDI GAALDTIQYS KH

2. ubiquitin

MQIFVKTLTG KTITLEVESS DTIDNVKSKI QDKEGIPPDQ QRLIFAGKQL EDGRTLSDYN IQKESTLHLV LRLRGG

Sample #1

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7


#NameIsotope labelingTypeConcentration
1entity[U-100% 15N]1 mM
2ubiquitin6 mM
3potassium phosphatenatural abundance50 mM
4sodium chloridenatural abundance50 mM
5sodium azidenatural abundance0.04 %
6D2O[U-100% 2H]10 %
7H2O90 %
Sample #2

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7


#NameIsotope labelingTypeConcentration
8entity[U-100% 13C; U-100% 15N]1 mM
9ubiquitin6 mM
10potassium phosphatenatural abundance50 mM
11sodium chloridenatural abundance50 mM
12sodium azidenatural abundance0.04 %
13D2O[U-100% 2H]10 %
14H2O90 %
Sample #3

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7, Details 5% Polyacrylamide gel


#NameIsotope labelingTypeConcentration
15entity[U-100% 15N]1 mM
16ubiquitin6 mM
17potassium phosphatenatural abundance50 mM
18sodium chloridenatural abundance50 mM
19sodium azidenatural abundance0.04 %
20D2O[U-100% 2H]10 %
21H2O90 %

Protein Blocks Logo
Calculated from 21 models in PDB: 2JY8, Strand ID: A Detail


RDC
45 RDC values in 1 lists
Field strength (1H) 600.13 MHz, Pressure 1 atm, Temperature 298 K, pH 7 Detail
Release date
2008-01-15
Citation
Ubiquitin recognition by the ubiquitin-associated domain of p62 involves a novel conformational switch
Long, J.E., Gallagher, T.R., Cavey, J.R., Sheppard, P.W., Ralston, S.H., Layfield, R., Searle, M.S.
J. Biol. Chem. (2008), 283, 5427-5440, PubMed 18083707 , DOI 10.1074/jbc.M704973200 ,
Related entities 1. P62 UBA, : 1 : 4 : 9 : 11 entities Detail
Related entities 2. ubiquitin, : 21 : 119 : 187 entities Detail
Interaction partners 1. P62 UBA, : 119 interactors Detail
Experiments performed 11 experiments Detail
NMR combined restraints 9 contents Detail
Keywords helical bundle, rearrangement, ubiquitin binding, three helices, ubiquitin associated domain