5SSU
DHFR:NADP+:FOL complex at 270 K (crystal 3)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-1 |
Synchrotron site | SSRL |
Beamline | BL12-1 |
Temperature [K] | 270 |
Detector technology | PIXEL |
Collection date | 2021-11-20 |
Detector | DECTRIS EIGER2 S 16M |
Wavelength(s) | 0.826533 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 34.095, 45.179, 99.085 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.720 - 1.120 |
R-factor | 0.1407 |
Rwork | 0.139 |
R-free | 0.16890 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 7lvc |
RMSD bond length | 0.008 |
RMSD bond angle | 1.027 |
Data reduction software | DIALS (3.5.2) |
Data scaling software | DIALS (3.5.2) |
Phasing software | PHENIX (1.20.1_4487) |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.240 | 1.140 |
High resolution limit [Å] | 1.120 | 1.120 |
Rmerge | 0.698 | |
Rpim | 0.134 | 2.876 |
Number of reflections | 109637 | 5582 |
<I/σ(I)> | 18.6 | 0.5 |
Completeness [%] | 96.3 | |
Redundancy | 28.3 | 29.5 |
CC(1/2) | 0.999 | 0.415 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 277 | 20 mM imadazole (pH 5.4-5.8), 16-21% PEG 400, 125 mM MnCl2 |