9MAA

The complex structure of Plpro and Frag794

This is a non-PDB format compatible entry.

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	2024-07-24
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9793
Spacegroup name	P 32 2 1
Unit cell lengths	81.400, 81.400, 135.090
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.110 - 2.380
R-factor	0.1988
Rwork	0.195
R-free	0.23280
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	0.978
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.19_4092: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.860	2.440
High resolution limit [Å]	2.380	2.380
Rmerge	0.282	1.664
Rmeas	0.289	1.710
Rpim	0.065	0.390
Total number of observations	415335	29320
Number of reflections	21391	1543
<I/σ(I)>	12.5	2.4
Completeness [%]	99.9
Redundancy	19.4	19
CC(1/2)	0.996	0.503

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	6	277	1.6 M Sodium Malonate Dibasic Monohydrate