7NZC

First SH3 domain of POSH (Plenty of SH3 Domains protein)

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-08-01
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9795
Spacegroup name	P 65 2 2
Unit cell lengths	35.962, 35.962, 181.333
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.694 - 1.111
Rwork	0.147
R-free	0.17750
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	modified 2SRC
RMSD bond length	0.010
RMSD bond angle	1.677
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (7.0.078)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.700	1.130
High resolution limit [Å]	1.110	1.110
Number of reflections	2677	404
<I/σ(I)>	26.1	1.4
Completeness [%]	96.0
Redundancy	19.4
CC(1/2)	0.999	0.565

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8	293	0.2 M NaF, 22% PEG 3350