2B0Q
Crystal Structure Of 3',5"-Aminoglycoside Phosphotransferase Type IIIa ADP Neomycin B Complex
Replaces: 1L8UExperimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X8C |
Synchrotron site | NSLS |
Beamline | X8C |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2000-04-27 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.07 |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 46.357, 46.357, 301.613 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.360 - 2.700 |
R-factor | 0.225 |
Rwork | 0.225 |
R-free | 0.31200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1l8t |
RMSD bond length | 0.008 |
RMSD bond angle | 1.396 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.048 | 0.168 |
Number of reflections | 8074 | |
<I/σ(I)> | 11.3 | 4.3 |
Completeness [%] | 80.8 | |
Redundancy | 3.4 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 277 | PEG 600, CHES, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |