3OID
Crystal Structure of Enoyl-ACP Reductases III (FabL) from B. subtilis (complex with NADP and TCL)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 4A |
Synchrotron site | PAL/PLS |
Beamline | 4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-14 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 58.376, 110.683, 85.169 |
Unit cell angles | 90.00, 91.82, 90.00 |
Refinement procedure
Resolution | 36.010 - 1.800 |
R-factor | 0.15086 |
Rwork | 0.149 |
R-free | 0.18061 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3oic |
RMSD bond length | 0.027 |
RMSD bond angle | 2.138 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.057 | 0.128 |
Total number of observations | 1861429 | |
Number of reflections | 100171 | |
<I/σ(I)> | 34.7 | 8.95 |
Completeness [%] | 99.2 | 94.9 |
Redundancy | 3.1 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 1.6M sodium citrate , pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |