******** 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