6J7U

Crystal structure of blue fluorescent protein from metagenomic library in complex with NADPH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-30
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9793
Spacegroup name	P 21 21 21
Unit cell lengths	54.662, 96.792, 168.937
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.777 - 2.302
R-factor	0.2064
Rwork	0.204
R-free	0.25650
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3v2g
RMSD bond length	0.014
RMSD bond angle	1.342
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.340
High resolution limit [Å]	2.300	2.300
Rpim	0.070	0.296
Number of reflections	40297	1987
<I/σ(I)>	8.5
Completeness [%]	99.5
Redundancy	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	9	294	0.1M BICINE pH 9.0, 0.3M Magnesium nitrate, 22% w/v PEG 2000, 4% v/v MPD