4LJC

Structure of an X-ray-induced photobleached state of IrisFP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-06-29
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.972
Spacegroup name	P 21 21 21
Unit cell lengths	86.102, 96.636, 139.711
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.869 - 1.860
R-factor	0.2037
Rwork	0.202
R-free	0.24600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2VVH - IRISFP FLUORESCENT PROTEIN IN ITS GREEN FORM CIS CONFORMATION
RMSD bond length	0.012
RMSD bond angle	1.631
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.410	1.960
High resolution limit [Å]	1.860	1.860
Number of reflections	99096
<I/σ(I)>	10.4
Completeness [%]	99.3	98.6
Redundancy	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	298	2.1M ammonium sulfate, 0.1M bicine, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K