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Solution NMR structure of BCoR in complex with AF9 (BCoR-AF9)
Authors
Schmidt, C.R., Kuntimaddi, A., Leach, B.I., Bushweller, J.H.
Assembly
BCoR-AF9
Entity
1. AF9 (polymer, Thiol state: all free), 70 monomers, 8266.313 Da Detail

MDKAYLDELV ELHRRLMTLR ERHILQQIVN LIEETGHFHI TNTTFDFDLC SLDKTTVRKL QSYLETSGTS


2. BCoR (polymer, Thiol state: all free), 34 monomers, 3764.136 Da Detail

GTTNSSSNHL EDPHYSELTN LKVCIELTGL HPKK


Total weight
12030.449 Da
Max. entity weight
8266.313 Da
Source organism
Homo sapiens
Exptl. method
solution NMR
Data set
assigned_chemical_shifts
Chem. Shift Complete1
Sequence coverage: 66.3 %, Completeness: 64.4 %, Completeness (bb): 66.1 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All64.4 % (788 of 1223)63.9 % (404 of 632)64.7 % (311 of 481)66.4 % (73 of 110)
Backbone66.1 % (410 of 620)65.7 % (138 of 210)66.2 % (204 of 308)66.7 % (68 of 102)
Sidechain63.3 % (445 of 703)63.0 % (266 of 422)63.7 % (174 of 273)62.5 % (5 of 8)
Aromatic53.7 % (44 of 82)53.7 % (22 of 41)53.7 % (22 of 41)
Methyl71.9 % (92 of 128)71.9 % (46 of 64)71.9 % (46 of 64)

1. AF9

MDKAYLDELV ELHRRLMTLR ERHILQQIVN LIEETGHFHI TNTTFDFDLC SLDKTTVRKL QSYLETSGTS

2. BCoR

GTTNSSSNHL EDPHYSELTN LKVCIELTGL HPKK

Sample

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0


#NameIsotope labelingTypeConcentration
1AF9[U-100% 13C; U-100% 15N]750 uM
2BCoR[U-100% 13C; U-100% 15N]750 uM
3Bis-Trisnatural abundance9.3 mM
4MESnatural abundance15.8 mM
5DTTnatural abundance1 mM
6D2O[U-2H]5 %
7H2Onatural abundance95 %
8NaClnatural abundance100 mM

Chem. Shift Complete2
Sequence coverage: 43.3 %, Completeness: 49.5 %, Completeness (bb): 52.9 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All49.5 % (1211 of 2446)48.1 % (608 of 1264)50.6 % (487 of 962)52.7 % (116 of 220)
Backbone52.9 % (656 of 1240)51.9 % (218 of 420)53.2 % (328 of 616)53.9 % (110 of 204)
Sidechain47.2 % (664 of 1406)46.2 % (390 of 844)49.1 % (268 of 546)37.5 % (6 of 16)
Aromatic31.1 % (51 of 164)29.3 % (24 of 82)32.9 % (27 of 82)
Methyl53.1 % (136 of 256)52.3 % (67 of 128)53.9 % (69 of 128)

1. AF9

MDKAYLDELV ELHRRLMTLR ERHILQQIVN LIEETGHFHI TNTTFDFDLC SLDKTTVRKL QSYLETSGTS

2. BCoR

GTTNSSSNHL EDPHYSELTN LKVCIELTGL HPKK

Sample

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 6.0


#NameIsotope labelingTypeConcentration
1AF9[U-100% 13C; U-100% 15N]750 uM
2BCoR[U-100% 13C; U-100% 15N]750 uM
3Bis-Trisnatural abundance9.3 mM
4MESnatural abundance15.8 mM
5DTTnatural abundance1 mM
6D2O[U-2H]5 %
7H2Onatural abundance95 %
8NaClnatural abundance100 mM

Release date
2017-10-03
Citation
Direct Recruitment of BCoR, but not CBX8, is Required for MLL-AF9 Leukemia
Schmidt, C.R., Achille, N.J., Kuntimaddi, A., Boulton, A.M., Leach, B.I., Zeleznik-Le, N.J., Bushweller, J.H.
Not known
Related entities 1. AF9, : 5 : 19 entities Detail
Related entities 2. BCoR, : 1 : 2 : 5 entities Detail
Interaction partners 1. AF9, : 3 : 1 interactors Detail
Interaction partners 2. BCoR, : 34 : 1 interactors Detail
Experiments performed 11 experiments Detail
NMR combined restraints 5 contents Detail