6CBO
X-ray structure of GenB1 from micromonospora echinospora in complex with neamine and PLP (as the external aldimine)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-06-10 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9498 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.888, 59.980, 210.694 |
Unit cell angles | 90.00, 95.19, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.600 |
R-factor | 0.15685 |
Rwork | 0.155 |
R-free | 0.18818 |
Structure solution method | SAD |
RMSD bond length | 0.011 |
RMSD bond angle | 1.735 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.048 | 0.111 |
Number of reflections | 201237 | 18111 |
<I/σ(I)> | 36.4 | 10.5 |
Completeness [%] | 92.3 | 83.4 |
Redundancy | 2.7 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 17-19% PEG-8000, 2% 2-propanol, 1 mM PLP, 5 mM neamine, 100 mM MES |