8CU5

Crystal Structure of Putative Cyclophilin B from Brugia malayi

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-09-01
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97740
Spacegroup name	I 41 2 2
Unit cell lengths	137.220, 137.220, 143.260
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.510 - 1.850
R-factor	0.1711
Rwork	0.170
R-free	0.19640
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4fru
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MoRDa
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.510	48.510	1.900
High resolution limit [Å]	1.850	8.270	1.850
Rmerge	0.044	0.014	0.608
Rmeas	0.046	0.015	0.643
Total number of observations	553484
Number of reflections	58246	749	4231
<I/σ(I)>	31.91	97.06	3.9
Completeness [%]	100.0	98.9	100
Redundancy	9.503	8.43	9.48
CC(1/2)	1.000	1.000	0.931

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	287	[Target: BrmaA.00538.a.B2.PD38321 - 20.5 mg/mL] [Barcode: 302391h9] [Pin: eko9-16] [Crystallization: sparse screen - JCSG+ H9 -100 mM Bis-Tris pH 5.5, 200 mM Lithium sulfate, 25% (w/v) PEG 3550, 14C, 0.4:0.4 drop ratio] [Cryo: 15% EG]