BMRB: 15144

Side-chain relaxation in SH3 domain from alpha-spectrin measured at multiple temperatures

Authors

Xue, Y., Pavlova, M.S., Ryabov, Y.E., Reif, B., Skrynnikov, N.R.

Assembly

SH3 monomer

Entity

1. SH3 monomer (polymer, Thiol state: not present), 62 monomers, 7219.162 Da Detail

MDETGKELVL ALYDYQEKSP REVTMKKGDI LTLLNSTNKD WWKVEVNDRQ GFVPAAYVKK LD

Formula weight

7219.162 Da

Source organism

Gallus gallus

Exptl. method

solution NMR

Data set

heteronucl_T1_relaxation, heteronucl_T2_relaxation, order_parameters

Heteronucl. T₁

252 T₁ values in 8 lists
Coherence Iz, Field strength (¹H) 600 MHz, Temperature 297 K, 283 K, 303 K, 290 K, pH 3.5 Detail

---

Temperature 283 K, pH 3.5

Experiment name methyl 2H R1

Temperature 290 K, pH 3.5

Experiment name methyl 2H R1

Temperature 297 K, pH 3.5

Experiment name methyl 2H R1

Temperature 303 K, pH 3.5

Experiment name methyl 2H R1

Temperature 283 K, pH 3.5

Experiment name methyl 2H R1

Temperature 290 K, pH 3.5

Experiment name methyl 2H R1

Temperature 297 K, pH 3.5

Experiment name methyl 2H R1

Temperature 303 K, pH 3.5

Experiment name methyl 2H R1

Heteronucl. T₂

252 T₂ values in 8 lists
Coherence I(+,-), Field strength (¹H) 600 MHz, Temperature 297 K, 283 K, 303 K, 290 K, pH 3.5 Detail

---

Temperature 283 K, pH 3.5

Experiment name methyl 2H R2

Temperature 290 K, pH 3.5

Experiment name methyl 2H R2

Temperature 303 K, pH 3.5

Experiment name methyl 2H R2

Temperature 283 K, pH 3.5

Experiment name methyl 2H R2

Temperature 290 K, pH 3.5

Experiment name methyl 2H R2

Temperature 297 K, pH 3.5

Experiment name methyl 2H R2

Temperature 303 K, pH 3.5

Experiment name methyl 2H R2

Heteronucl. T₁/T₂

224 T₁/T₂ values in 7 lists
Field strength (¹H) 600 MHz, Temperature 297 K, 283 K, 303 K, 290 K, pH 3.5 Detail

---

Temperature 283 K, pH 3.5

Temperature 290 K, pH 3.5

Temperature 303 K, pH 3.5

Temperature 283 K, pH 3.5

Temperature 290 K, pH 3.5

Temperature 297 K, pH 3.5

Temperature 303 K, pH 3.5

Order parameters

244 S² values in 8 lists
Temperature 297 K, 283 K, 303 K, 290 K, pH 3.5 Detail

---

Temperature 283 K, pH 3.5

Experiment name methyl 2H R1, methyl 2H R2

List #1 S2_taue_pyruvate1, Details temperatures 10C (in this particular order)

Temperature 290 K, pH 3.5

Experiment name methyl 2H R1, methyl 2H R2

List #2 S2_taue_pyruvate2, Details temperatures 17C (in this particular order)

List #6 S2_taue_glucose2, Details temperatures 17C (in this particular order)

Temperature 297 K, pH 3.5

Experiment name methyl 2H R1, methyl 2H R2

List #3 S2_taue_pyruvate3, Details temperatures 24C (in this particular order)

List #7 S2_taue_glucose3, Details temperatures 24C in this particular order)

Temperature 303 K, pH 3.5

Experiment name methyl 2H R1, methyl 2H R2

List #4 S2_taue_pyruvate4, Details temperatures 30C (in this particular order)

List #8 S2_taue_glucose4, Details temperatures 30C (in this particular order)

Temperature 283 K, pH 3.5

Experiment name methyl 2H R1, methyl 2H R2

List #5 S2_taue_glucose1, Details temperatures 10C (in this particular order)

Release date

2007-05-09

Citation

Methyl rotation barriers in proteins from 2H relaxation data. Implications for protein structure
Xue, Y., Pavlova, M.S., Ryabov, Y.E., Reif, B., Skrynnikov, N.R.
J. Am. Chem. Soc. (2007), 129, 6827-6838, PubMed 17488010 , DOI 10.1021/ja0702061 , Abstract

Related entities 1. SH3 monomer, : 1 : 11 : 2 : 36 : 272 entities Detail

Interaction partners 1. SH3 monomer, : 5 interactors Detail

Experiments performed 4 experiments Detail