7VVW
MmtN-SAM complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-10-21 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97915 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.017, 129.308, 134.248 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 93.130 - 2.110 |
R-factor | 0.2033 |
Rwork | 0.202 |
R-free | 0.23350 |
Structure solution method | SAD |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | AutoSol |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 93.130 | 2.190 |
High resolution limit [Å] | 2.110 | 2.110 |
Rmerge | 0.115 | 1.205 |
Rmeas | 0.119 | 1.252 |
Rpim | 0.034 | 0.337 |
Number of reflections | 61893 | 6159 |
<I/σ(I)> | 12.8 | 2.3 |
Completeness [%] | 98.6 | 99.94 |
Redundancy | 12.8 | 13.7 |
CC(1/2) | 0.998 | 0.911 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 0.2M sodium acetate trihydrate, 0.1M sodium cacodylate trihydrate pH 6.5, 15% (wt/vol) PEG 8000 |