9CQF

CRYSTAL STRUCTURE OF APO C-TERMINAL HIS-TAG DOG HSP47(36-418) IN A C 2 2 21 CRYSTAL FORM

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-24
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	1.0
Spacegroup name	C 2 2 21
Unit cell lengths	117.780, 129.940, 501.930
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	250.970 - 2.928
R-factor	0.2293
Rwork	0.228
R-free	0.25180
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.040
Data reduction software	XDS (Mar 15, 2019)
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.11.8)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	250.965	250.965	3.207
High resolution limit [Å]	2.927	8.917	2.927
Rmerge	0.220	0.062	1.107
Rmeas	0.237	0.067	1.201
Rpim	0.089	0.025	0.460
Total number of observations	437083	21364	20106
Number of reflections	63276	3164	3165
<I/σ(I)>	7.11	20.73	1.64
Completeness [%]	93.9	99.9	65.6
Redundancy	6.91	6.75	6.35
CC(1/2)	0.992	0.997	0.658

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	200 mM Lithium Citrate Tribasic, 20% (w/v) PEG 3350