7QQ0

X-ray structure of the adduct obtained upon reaction of [cis-Rh2(OCOCH3)2(OCOCF3)2] with RNase A (2)

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ELETTRA BEAMLINE 11.2C
Synchrotron site	ELETTRA
Beamline	11.2C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-05-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00
Spacegroup name	C 1 2 1
Unit cell lengths	100.210, 32.560, 72.610
Unit cell angles	90.00, 90.31, 90.00

Refinement procedure

Resolution	41.140 - 1.320
Rwork	0.209
R-free	0.24300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1jvt
RMSD bond length	0.013
RMSD bond angle	3.098
Data reduction software	AutoProcess
Data scaling software	AutoProcess
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.143	1.350
High resolution limit [Å]	1.320	1.320
Rmerge	0.138	0.862
Rpim	0.100	0.570
Number of reflections	54908	2752
<I/σ(I)>	10.8	2.2
Completeness [%]	99.5	100
Redundancy	5.5	5.8
CC(1/2)	0.996	0.704

Crystallization Conditions

crystal ID	method	pH	temperature	details
1