6NMK
Binary complex structure of the T130K mutant of ANT-4'' with Neomycin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-12-17 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97857 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 59.000, 97.710, 101.970 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 51.068 - 1.940 |
R-factor | 0.1722 |
Rwork | 0.170 |
R-free | 0.21050 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.205 |
Data reduction software | HKL-3000 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.070 | 1.940 |
High resolution limit [Å] | 1.940 | 1.900 |
Rmerge | 0.056 | 0.374 |
Rmeas | 0.061 | 0.408 |
Rpim | 0.023 | 0.159 |
Number of reflections | 45570 | 2739 |
<I/σ(I)> | 18.5 | 4.4 |
Completeness [%] | 97.0 | 93.7 |
Redundancy | 6.5 | 6 |
CC(1/2) | 0.998 | 0.905 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 285 | 16-17% PEG 8K, 0.1 M Tris pH 7-8, 0.1-0.2 M MgCl2, 2-4 mM Neomycin |