2WWG
Plasmodium falciparum thymidylate kinase in complex with dGMP and ADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-04-18 |
| Detector | ADSC CCD |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 110.741, 110.741, 119.361 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 95.900 - 2.400 |
| R-factor | 0.19342 |
| Rwork | 0.190 |
| R-free | 0.25759 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wwf |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.860 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.150 | 0.940 |
| Number of reflections | 33557 | |
| <I/σ(I)> | 18.3 | 3.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10.9 | 10.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 4 MM HEPES PH 7.5, 1.32 M TRI- SODIUM CITRATE, 80 MM NACL, 3 % XYLITOL |
