9TPH

Survivin 1-127 in complex with a molecular tweezer-Histone-H3-peptide conjugate

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-02-05
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.999891
Spacegroup name	C 1 2 1
Unit cell lengths	101.549, 64.091, 75.872
Unit cell angles	90.00, 141.42, 90.00

Refinement procedure

Resolution	49.970 - 2.000
R-factor	0.2163
Rwork	0.214
R-free	0.26290
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	2.247
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	49.970	49.970	2.050
High resolution limit [Å]	2.000	8.940	2.000
Rmerge	0.196	0.037	1.935
Rmeas	0.213	0.040	2.091
Total number of observations	136802
Number of reflections	20209	245	1469
<I/σ(I)>	9.45	60.78	0.9
Completeness [%]	96.9	92.8	96.2
Redundancy	6.769	6.465	6.876
CC(1/2)	0.996	1.000	0.492

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	277	0.1M imidazole pH 8.0, 0.05M Ca-acetate, 35% v/v 2-ethoxyethanol