4Q38
The crystal structure of acyltransferase in complex with decanoyl-CoA and teicoplanin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL15A |
Synchrotron site | NSRRC |
Beamline | BL15A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-03-21 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 1.0000 |
Spacegroup name | P 65 |
Unit cell lengths | 133.806, 133.806, 49.301 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 22.500 - 1.990 |
R-factor | 0.19316 |
Rwork | 0.192 |
R-free | 0.22033 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mfj |
RMSD bond length | 0.007 |
RMSD bond angle | 1.181 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASES |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.070 |
High resolution limit [Å] | 1.990 | 2.000 |
Number of reflections | 34606 | |
Completeness [%] | 99.8 | 99.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1mM MES, 0.2M ammonium sulphate, 30%(V/V) PEG 5000 MME, 1mM decanoyl-CoA, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |