1SDN
CRYSTAL STRUCTURE OF A DEACYLATION-DEFECTIVE MUTANT OF PENICILLIN-BINDING PROTEIN 5 MODIFIED BY MERCURY
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | ENRAF-NONIUS FR591 |
| Temperature [K] | 294 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-08-20 |
| Detector | MAC Science DIP-2000H |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 32 |
| Unit cell lengths | 50.700, 50.700, 140.300 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 15.000 - 2.500 |
| R-factor | 0.17447 |
| Rwork | 0.171 |
| R-free | 0.24142 |
| Structure solution method | REFINEMENT |
| Starting model (for MR) | 1hd8 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.275 |
| Data reduction software | NONIUS |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.400 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.074 | 0.203 |
| Number of reflections | 13482 | |
| <I/σ(I)> | 11.2 | 4.4 |
| Completeness [%] | 95.6 | 88.7 |
| Redundancy | 2.53 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 294 | 24% (w/v) polyethylene glycol 8000, 50mM sodium citrate, 100mM magnesium acetate, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
