8OW6

PERIDININ-CHLOROPHYLL-PROTEIN OF HETEROCAPSA PYGMAEA, 100K

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	CCD
Collection date	2009-11-15
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9788
Spacegroup name	P 3 1 2
Unit cell lengths	90.610, 90.610, 155.610
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.500 - 1.200
R-factor	0.1626
Rwork	0.149
R-free	0.17050
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	1.027
Data reduction software	XDS (VERSION Feb 5, 2021 BUILT=20210323)
Data scaling software	XSCALE (VERSION Feb 5, 2021 BUILT=20210323)
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.500	1.230
High resolution limit [Å]	1.200	1.200
Rmerge	0.107	0.782
Rmeas	0.119	0.942
Number of reflections	227100	16634
<I/σ(I)>	8.11	1.31
Completeness [%]	99.9
Redundancy	5.2
CC(1/2)	0.995	0.386

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	291.15	0.82 M NaH2PO4 1.24 M K2HPO4 100 mM Na-acetate at pH 5.5 100 mM LiSO4