8BNS
Crystal structure of Pif1 from Sulfurihydrogenibium sp in complex with ADP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-12-25 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.977760 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 113.138, 129.292, 113.685 |
Unit cell angles | 90.00, 103.40, 90.00 |
Refinement procedure
Resolution | 110.590 - 3.240 |
R-factor | 0.2394 |
Rwork | 0.238 |
R-free | 0.26970 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ftd |
RMSD bond length | 0.005 |
RMSD bond angle | 1.010 |
Data reduction software | autoPROC |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 110.590 | 3.570 |
High resolution limit [Å] | 3.240 | 3.240 |
Rmerge | 0.150 | 0.709 |
Rmeas | 0.179 | 0.840 |
Rpim | 0.096 | 0.447 |
Number of reflections | 31700 | 1586 |
<I/σ(I)> | 5.2 | 1.7 |
Completeness [%] | 91.6 | 66.2 |
Redundancy | 3.4 | 3.4 |
CC(1/2) | 0.996 | 0.726 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | Tris-HCl 0.1M PEG 4K 20% PEG 200 5% |