7BJN
Crystal structure of atypical Tm1 (Tm1-I/C), residues 270-334
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-08-31 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0723 |
Spacegroup name | H 3 |
Unit cell lengths | 127.880, 127.880, 34.170 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 63.940 - 2.300 |
R-factor | 0.2357 |
Rwork | 0.234 |
R-free | 0.26950 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | poly Ala helix |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | AMPLE |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 63.940 | 63.940 | 2.360 |
High resolution limit [Å] | 2.300 | 10.280 | 2.300 |
Rmerge | 0.093 | 0.033 | 0.984 |
Rmeas | 0.103 | 0.037 | 1.097 |
Total number of observations | 48426 | ||
Number of reflections | 9264 | 106 | 664 |
<I/σ(I)> | 10.45 | 37.35 | 1.33 |
Completeness [%] | 99.8 | 99.1 | 98.2 |
Redundancy | 5.227 | 5.5 | 5.066 |
CC(1/2) | 0.998 | 0.999 | 0.559 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 0.1 M NH4Ac pH 4.6, 15% (w/v) PEG 4000 |