9HTR

Structure of CypD in complex with an inhibitor.

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-09-18
Detector	DECTRIS EIGER R 4M
Wavelength(s)	1.54
Spacegroup name	P 43 21 2
Unit cell lengths	57.131, 57.131, 117.774
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.210 - 2.250
R-factor	0.1617
Rwork	0.160
R-free	0.18480
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.794
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.000	2.320
High resolution limit [Å]	2.250	2.250
Number of reflections	9525	857
<I/σ(I)>	13.9
Completeness [%]	98.0	99
Redundancy	6.5
CC(1/2)	0.997	0.837

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	4M potassium formate, 0.1M BIS-TRIS propane pH 9, 2% w/v PEG2000