8Z1R
isocitrate lyase MoMcl1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL02U1 |
Synchrotron site | SSRF |
Beamline | BL02U1 |
Temperature [K] | 291.15 |
Detector technology | PIXEL |
Collection date | 2024-03-12 |
Detector | DECTRIS EIGER2 S 9M |
Wavelength(s) | 0.987 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 118.430, 150.495, 128.243 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.810 - 1.820 |
R-factor | 0.1856 |
Rwork | 0.184 |
R-free | 0.21540 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.765 |
Data reduction software | HKL-3000 (7.21) |
Data scaling software | HKL-3000 (7.21) |
Phasing software | PHASER (2.7.0) |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.810 | 1.885 |
High resolution limit [Å] | 1.820 | 1.820 |
Rmerge | 0.136 | |
Rmeas | 0.142 | |
Rpim | 0.041 | 0.538 |
Number of reflections | 102343 | 10172 |
<I/σ(I)> | 14.46 | |
Completeness [%] | 100.0 | |
Redundancy | 12.2 | |
CC(1/2) | 0.999 | 0.727 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.6 | 291.15 | 4% v/v TacsimateTM pH 8.0, 12% w/v Polyethylene glycol 3,350 |