5YCC

Crystal structure of Notothenia coriiceps adenylate kinase variant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2017-07-29
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97933
Spacegroup name	P 41 21 2
Unit cell lengths	105.200, 105.200, 83.779
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.347 - 2.700
R-factor	0.1709
Rwork	0.168
R-free	0.22250
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5x6k
RMSD bond length	0.008
RMSD bond angle	1.160
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.800
High resolution limit [Å]	2.700	2.700
Rpim	0.036	0.204
Number of reflections	13506	1313
<I/σ(I)>	22.1	4.3
Completeness [%]	99.9	100
Redundancy	16	16.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	0.14M Lithium sulfate, 45% PEG400, 0.1M ACETATE pH4.0