4D1D
STRUCTURE OF MHP1, A NUCLEOBASE-CATION-SYMPORT-1 FAMILY TRANSPORTER with the inhibitor 5-(2-naphthylmethyl)-L-hydantoin.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 287 |
Detector technology | CCD |
Collection date | 2011-09-19 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 87.600, 106.900, 106.800 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.777 - 3.700 |
R-factor | 0.2606 |
Rwork | 0.256 |
R-free | 0.30770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4d1a |
RMSD bond length | 0.008 |
RMSD bond angle | 1.274 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.000 | 3.800 |
High resolution limit [Å] | 3.700 | 3.700 |
Rmerge | 0.060 | 0.690 |
Number of reflections | 10714 | |
<I/σ(I)> | 8.3 | 2 |
Completeness [%] | 97.0 | 96 |
Redundancy | 3.3 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | PROTEIN WAS CRYSTALLIZED FROM 27-33 % PEG 300, 0.1 M NACL AND 0.1M NA-PHOSPHATE (PH 7.0). NMH WAS ADDED TO THE DROP AS A SATURATED SOLUTION. |