2HVE

S120G mutant of human nucleoside diphosphate kinase A complexed with ADP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM30A
Synchrotron site	ESRF
Beamline	BM30A
Temperature [K]	100
Detector technology	CCD
Collection date	2004-09-04
Detector	MARRESEARCH
Wavelength(s)	0.980
Spacegroup name	P 41 21 2
Unit cell lengths	114.824, 114.824, 89.719
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 2.402
R-factor	0.22078
Rwork	0.218
R-free	0.27725
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ucn
RMSD bond length	0.009
RMSD bond angle	1.256
Data reduction software	MOSFLM
Data scaling software	CCP4 ((SCALA))
Refinement software	REFMAC (5.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.530
High resolution limit [Å]	2.402	2.402
Number of reflections	22088
<I/σ(I)>	21.4	4
Completeness [%]	97.1	86.7
Redundancy	10.9	8.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	2.4 M AMMONIUM SULPHATE, 10 MM ADP, 20 MM MGCL2, 4 MM DTT, 0.1 M MES, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K