8E6M
X-ray structure of the Deinococcus radiodurans Nramp/MntH divalent transition metal transporter WT in an inward-open, cadmium-bound state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-12-06 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 1 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 59.137, 71.369, 99.054 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.540 - 2.480 |
R-factor | 0.2077 |
Rwork | 0.203 |
R-free | 0.25040 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 8e5s |
Data reduction software | XDS |
Data scaling software | Aimless (0.7.4) |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 45.540 | 45.540 | 2.580 |
High resolution limit [Å] | 2.480 | 8.940 | 2.480 |
Rmerge | 0.164 | 0.028 | 1.626 |
Rmeas | 0.184 | 0.032 | 1.831 |
Rpim | 0.083 | 0.014 | 0.823 |
Total number of observations | 74940 | 1570 | 8196 |
Number of reflections | 15312 | 365 | 1697 |
<I/σ(I)> | 8.1 | 31.4 | 1.1 |
Completeness [%] | 99.4 | 96.1 | 99.7 |
Redundancy | 4.9 | 4.3 | 4.8 |
CC(1/2) | 0.996 | 0.999 | 0.367 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 6.1 | 298 | 24% PEG400, 0.1 M MES, pH 6.1, 50 mM succinic acid, pH 6.0, 20 mM spermidine, pH 7.0 |