9WRJ

Crystal structure of CtBP1 in complex with PALI1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-10-19
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97861
Spacegroup name	P 64 2 2
Unit cell lengths	88.869, 88.869, 165.087
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	44.760 - 2.200
R-factor	0.20261
Rwork	0.199
R-free	0.26192
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.629
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.330
High resolution limit [Å]	2.200	6.530	2.200
Rmerge	0.159	0.030	2.968
Rmeas	0.163	0.031	3.701
Number of reflections	20286	907	3164
<I/σ(I)>	17.11	76.16	1.01
Completeness [%]	99.4	99.3	98.3
Redundancy	17.88	14.99	10.4
CC(1/2)	0.999	1.000	0.298

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	291	30% pentaerythritol ethoxylate, 0.1 M magnesium formate dihydrate, 0.1 M Tris pH 8.5