8TNM

UNC_079 from Chroma generative model

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-03-10
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97624
Spacegroup name	P 43 21 2
Unit cell lengths	59.532, 59.532, 89.178
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.690 - 1.100
R-factor	0.1881
Rwork	0.187
R-free	0.20730
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.839
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.690	1.130
High resolution limit [Å]	1.100	1.100
Rmerge	0.053	2.340
Number of reflections	65204	4392
<I/σ(I)>	15.2
Completeness [%]	99.2
Redundancy	12.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	2.1 M DL-malic acid, pH 7.0