******** PROTEIN ********
Name: At3g01050.1
Organism: Arabidopsis thaliana
Expression system: Wheat germ cell-free system
PDB code: 1se9
BMRB code: 6128
Sample conditions: 0.5 mM [U-15N; U-13C]At3g01050
50 mM KCl
10 mM phosphate buffer
1 mM DTT
pH 6.5, 298 K
******** NMR EXPERIMENTS ********
Spectrometer: Bruker DRX 600 MHz
HSQC: 15N HSQC, 13C aliphatic CT-HSQC, 13C aromatic CT-HSQC,
13C aromatic HSQC
Triple resonance: HNCA, HNCO, HNCOCA, HNCACO, CCONH, HCCH-TOCSY,
3D 15N-TOCSY
NOESY: 3D 15N-NOESY, 3D 13C-NOESY, 3D 13C-NOESY aromatic
Other: Diffusion, hetNOE
--Each directory contains raw data, pulse sequences, acquisition parameters,
and processing scripts (if used)
******** SOFTWARE ********
Collection: XWINNMR
Processing: NMRPipe
Analysis: XEASY
Peak picking: SPSCAN and XEASY
Backbone assignments: GARANT
Structure calculation: CYANA (CANDID used for automated NOE assignments)
Water refinement: XPLOR-NIH
******** CONTACT ********
Brian F. Volkman: bvolkman@biochem.mcw.edu
Sample
Directory Exp # Jar ID Experiment Comments
071103.3g01050 1 1D
071103.3g01050 2 15N HSQC weak sample
071103.3g01050 3 15N Noesy no cross-peaks
071103.3g01050 4 15N HSQC
071103.3g01050 11 1D run 07-17-03
071103.3g01050 12 15N HSQC run 07-17-03
071103.3g01050 1 3391 1D
071103.3g01050 2 3391 15N HSQC weaker than 15N sample
071103.3g01050 3 3391 HNCA crashed
071103.3g01050 4 3391 HNCA
071103.3g01050 5 3391 15N HSQC
071103.3g01050 6 3391 HNCO
071703.3g01050 1 3392 1D
071703.3g01050 2 3392 15N HSQC
071703.3g01050 3 3392 HNCA used for structure determination
071703.3g01050 4 3392 HNCO used for structure determination
071703.3g01050 5 3392 15N HSQC used for structure determination
071703.3g01050 6 3392 HNCOCA used for structure determination
071703.3g01050 7 3392 15N HSQC
071703.3g01050 8 3392 HNCACB used for structure determination
071703.3g01050 9 3392 15N HSQC
071703.3g01050 10 3392 HNCACO used for structure determination
071703.3g01050 11 3392 15N HSQC
071703.3g01050 12 3392 15N-TOCSY used for structure determination
071703.3g01050 13 3392 15N HSQC
072103.3g01050 2 3392 CCONH used for structure determination
072103.3g01050 3 3392 HCCH-Tocsy used for structure determination
072103.3g01050 4 3392 15N HSQC
072103.3g01050 10 3392 1D
072303.3g01050 1 3458 1D
072303.3g01050 2 3458 15N HSQC
072303.3g01050 3 3458 15N HSQC
072403.3g01050 1 3458 1D
072403.3g01050 2 3458 15N HSQC
072403.3g01050 3 3458 15N HSQC
072403.3g01050 4 3458 HCCH-Tocsy used for structure determination
072503.3g01050 1 3458 13C alaphatic CT-HSQC not used - wrong bf2
072503.3g01050 2 3458 13C Noesy used for structure determination
072503.3g01050 3 3458 13C aromatic CT-HSQC used for structure determination
072503.3g01050 4 3458 15N HSQC
072503.3g01050 9 3458 15N HSQC
072503.3g01050 10 3458 15N Noesy not used - no 13C decoupling
072503.3g01050 11 3458 15N HSQC
072503.3g01050 12 3458 13C aromatic HSQC used for structure determination
073103.3g01050 1 3458 15N HSQC
073103.3g01050 2 3458 CCONH used for structure determination
073103.3g01050 3 3458 13C alaphatic CT-HSQC used for structure determination
073103.3g01050 11 3458 1D
073103.3g01050 12 3458 Diffusion
073103.3g01050 13 3458 1D
073103.3g01050 14 3458 Diffusion
080103.3g01050 1 3458 15N HSQC
080103.3g01050 2 3458 15N Noesy u sed for structure determination
080103.3g01050 3 3458 13C aromatic Noesy used for structure determination
080103.3g01050 4 3458 15N HSQC
080103.3g01050 5 3458 HNCA used for structure determination
080103.3g01050 6 3458 HNCO used for structure determination
080103.3g01050 7 3458 HNCOCA used for structure determination
080103.3g01050 8 3458 15N HSQC
080606.3g01050 1 3458 1D
080606.3g01050 2 3458 15N HSQC
080606.3g01050 3 3458 13C aromatic Noesy
080606.3g01050 4 3458 15N HSQC
082903.3g01050 1 3458 15N HSQC
082903.3g01050 2 3458 15N Noesy
082903.3g01050 3 3458 15N HSQC
110603.3g01050 1 4126 1D
110603.3g01050 2 4126 15N HSQC
110603.3g01050 3 4126 15N hetNOE
110603.3g01050 4 4126 15N HSQC
110603.3g01050 5 4126 15N Noesy
110603.3g01050 6 4126 15N HSQC
110603.3g01050 10 4126 hetNOE data
110603.3g01050 11 4126 hetNOE data
******** PROTEIN ********
Name: At3g01050.1
Organism: Arabidopsis thaliana
Expression system: Wheat germ cell-free system
PDB code: 1se9
BMRB code: 6128
Sample conditions: 0.5 mM [U-15N; U-13C]At3g01050
50 mM KCl
10 mM phosphate buffer
1 mM DTT
pH 6.5, 298 K
******** NMR EXPERIMENTS ********
Spectrometer: Bruker DRX 600 MHz
HSQC: 15N HSQC, 13C aliphatic CT-HSQC, 13C aromatic CT-HSQC,
13C aromatic HSQC
Triple resonance: HNCA, HNCO, HNCOCA, HNCACO, CCONH, HCCH-TOCSY,
3D 15N-TOCSY
NOESY: 3D 15N-NOESY, 3D 13C-NOESY, 3D 13C-NOESY aromatic
Other: Diffusion, hetNOE
--Each directory contains raw data, pulse sequences, acquisition parameters,
and processing scripts (if used)
******** SOFTWARE ********
Collection: XWINNMR
Processing: NMRPipe
Analysis: XEASY
Peak picking: SPSCAN and XEASY
Backbone assignments: GARANT
Structure calculation: CYANA (CANDID used for automated NOE assignments)
Water refinement: XPLOR-NIH
******** CONTACT ********
Brian F. Volkman: bvolkman@biochem.mcw.edu
Sample
Directory Exp # Jar ID Experiment Comments
071103.3g01050 1 1D
071103.3g01050 2 15N HSQC weak sample
071103.3g01050 3 15N Noesy no cross-peaks
071103.3g01050 4 15N HSQC
071103.3g01050 11 1D run 07-17-03
071103.3g01050 12 15N HSQC run 07-17-03
071103.3g01050 1 3391 1D
071103.3g01050 2 3391 15N HSQC weaker than 15N sample
071103.3g01050 3 3391 HNCA crashed
071103.3g01050 4 3391 HNCA
071103.3g01050 5 3391 15N HSQC
071103.3g01050 6 3391 HNCO
071703.3g01050 1 3392 1D
071703.3g01050 2 3392 15N HSQC
071703.3g01050 3 3392 HNCA used for structure determination
071703.3g01050 4 3392 HNCO used for structure determination
071703.3g01050 5 3392 15N HSQC used for structure determination
071703.3g01050 6 3392 HNCOCA used for structure determination
071703.3g01050 7 3392 15N HSQC
071703.3g01050 8 3392 HNCACB used for structure determination
071703.3g01050 9 3392 15N HSQC
071703.3g01050 10 3392 HNCACO used for structure determination
071703.3g01050 11 3392 15N HSQC
071703.3g01050 12 3392 15N-TOCSY used for structure determination
071703.3g01050 13 3392 15N HSQC
072103.3g01050 2 3392 CCONH used for structure determination
072103.3g01050 3 3392 HCCH-Tocsy used for structure determination
072103.3g01050 4 3392 15N HSQC
072103.3g01050 10 3392 1D
072303.3g01050 1 3458 1D
072303.3g01050 2 3458 15N HSQC
072303.3g01050 3 3458 15N HSQC
072403.3g01050 1 3458 1D
072403.3g01050 2 3458 15N HSQC
072403.3g01050 3 3458 15N HSQC
072403.3g01050 4 3458 HCCH-Tocsy used for structure determination
072503.3g01050 1 3458 13C alaphatic CT-HSQC not used - wrong bf2
072503.3g01050 2 3458 13C Noesy used for structure determination
072503.3g01050 3 3458 13C aromatic CT-HSQC used for structure determination
072503.3g01050 4 3458 15N HSQC
072503.3g01050 9 3458 15N HSQC
072503.3g01050 10 3458 15N Noesy not used - no 13C decoupling
072503.3g01050 11 3458 15N HSQC
072503.3g01050 12 3458 13C aromatic HSQC used for structure determination
073103.3g01050 1 3458 15N HSQC
073103.3g01050 2 3458 CCONH used for structure determination
073103.3g01050 3 3458 13C alaphatic CT-HSQC used for structure determination
073103.3g01050 11 3458 1D
073103.3g01050 12 3458 Diffusion
073103.3g01050 13 3458 1D
073103.3g01050 14 3458 Diffusion
080103.3g01050 1 3458 15N HSQC
080103.3g01050 2 3458 15N Noesy u sed for structure determination
080103.3g01050 3 3458 13C aromatic Noesy used for structure determination
080103.3g01050 4 3458 15N HSQC
080103.3g01050 5 3458 HNCA used for structure determination
080103.3g01050 6 3458 HNCO used for structure determination
080103.3g01050 7 3458 HNCOCA used for structure determination
080103.3g01050 8 3458 15N HSQC
080606.3g01050 1 3458 1D
080606.3g01050 2 3458 15N HSQC
080606.3g01050 3 3458 13C aromatic Noesy
080606.3g01050 4 3458 15N HSQC
082903.3g01050 1 3458 15N HSQC
082903.3g01050 2 3458 15N Noesy
082903.3g01050 3 3458 15N HSQC
110603.3g01050 1 4126 1D
110603.3g01050 2 4126 15N HSQC
110603.3g01050 3 4126 15N hetNOE
110603.3g01050 4 4126 15N HSQC
110603.3g01050 5 4126 15N Noesy
110603.3g01050 6 4126 15N HSQC
110603.3g01050 10 4126 hetNOE data
110603.3g01050 11 4126 hetNOE data