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Solution Structure of the 30 Kda N-terminal Domain of Enzyme I of the Escherichia coli Phosphoenolpyruvate:Sugar Phosphotransferase System by Multidimensional NMR
Authors
Garrett, D.S., Seok, Y., Liao, D., Peterkofsky, A., Gronenborn, A.M., Clore, M.G.
Assembly
N-terminal Domain of Enzyme I
Entity
1. N-terminal Domain of Enzyme I (polymer), 259 monomers, 28345.97 Da Detail

MISGILASPG IAFGKALLLK EDEIVIDRKK ISADQVDQEV ERFLSGRAKA SAQLETIKTK AGETFGEEKE AIFEGHIMLL EDEELEQEII ALIKDKHMTA DAAAHEVIEG QASALEELDD EYLKERAADV RDIGKRLLRN ILGLKIIDLS AIQDEVILVA ADLTPSETAQ LNLKKVLGFI TDAGGRTSHT SIMARSLELP AIVGTGSVTS QVKNDDYLIL DAVNNQVYVN PTNEVIDKMR AVQEQVASEK AELAKLKDR


Formula weight
28345.97 Da
Source organism
Escherichia coli
Exptl. method
NMR
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 99.6 %, Completeness: 68.2 %, Completeness (bb): 68.1 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All68.2 % (2022 of 2963)76.9 % (1175 of 1528)69.4 % (799 of 1151)16.9 % (48 of 284)
Backbone68.1 % (1043 of 1531)95.7 % (492 of 514)67.6 % (515 of 762)14.1 % (36 of 255)
Sidechain72.4 % (1214 of 1676)66.9 % (678 of 1014)82.8 % (524 of 633)41.4 % (12 of 29)
Aromatic38.9 % (35 of 90)62.2 % (28 of 45)15.6 % (7 of 45)
Methyl88.5 % (322 of 364)89.6 % (163 of 182)87.4 % (159 of 182)

1. N-terminal Domain of Enzyme I

MISGILASPG IAFGKALLLK EDEIVIDRKK ISADQVDQEV ERFLSGRAKA SAQLETIKTK AGETFGEEKE AIFEGHIMLL EDEELEQEII ALIKDKHMTA DAAAHEVIEG QASALEELDD EYLKERAADV RDIGKRLLRN ILGLKIIDLS AIQDEVILVA ADLTPSETAQ LNLKKVLGFI TDAGGRTSHT SIMARSLELP AIVGTGSVTS QVKNDDYLIL DAVNNQVYVN PTNEVIDKMR AVQEQVASEK AELAKLKDR

Sample #1

Temperature 313 (±2) K, pH 7.5 (±0.5)


#NameIsotope labelingTypeConcentration
1N-terminal Domain of Enzyme I[U-95% 2H; U-99% 13C; U-99% 15N]1.4 ~ 1.5 mM
Sample #2

Temperature 313 (±2) K, pH 7.5 (±0.5)


#NameIsotope labelingTypeConcentration
2N-terminal Domain of Enzyme I[U-100% 1H; U-100% 12C; U-99%1 5N]1.4 ~ 1.5 mM
Sample #3

Temperature 313 (±2) K, pH 7.5 (±0.5)


#NameIsotope labelingTypeConcentration
3N-terminal Domain of Enzyme I[U-100% 2H; U-100% 12C; U-99% 15N]1.4 ~ 1.5 mM

LACS Plot; CA
Referencing offset: -0.25 ppm, Outliers: 1 Detail
LACS Plot; CB
Referencing offset: -0.25 ppm, Outliers: 1 Detail
LACS Plot; HA
Referencing offset: 0.02 ppm, Outliers: 1 Detail
Release date
2000-06-18
Citation 1
Solution structure of the 30 kDa N-terminal domain of enzyme I of the Escherichia coli phosphoenolpyruvate:sugar phosphotransferase system by multidimensional NMR
Garrett, D.S., Seok, Y., Liao, D., Peterkofsky, A., Gronenborn, A.M., Clore, M.G.
Biochemistry (1997), 36, 2517-2530, PubMed 9054557 , DOI 10.1021/bi962924y ,
Citation 2
1H, 13C and 15N chemical shift referencing in biomolecular NMR
Wishart, D.S., Bigam, C.G., Yao, J., Abildgaard, F., Dyson, H.J., Oldfield, E., Markley, J.L., Sykes, B.D.
J. Biomol. NMR (1995), 6, 135-140, PubMed 8589602 , DOI 10.1007/bf00211777 ,
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    Title PT1_ECOLI Entity Phosphoenolpyruvate-protein phosphotransferase
Related entities 1. N-terminal Domain of Enzyme I, : 1 : 8 : 9 : 49 entities Detail
Interaction partners 1. N-terminal Domain of Enzyme I, : 11 interactors Detail
Keywords kinase, phosphotransferase, sugar transport