8OO3

X-ray structure of the adduct formed upon reaction of cisplatin with human angiogenin after 5 days soaking

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	2021-03-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00
Spacegroup name	P 21 21 2
Unit cell lengths	85.320, 37.480, 38.330
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.660 - 1.760
Rwork	0.243
R-free	0.29050
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.724
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.660	1.790
High resolution limit [Å]	1.760	1.760
Rmerge	0.083	0.636
Number of reflections	12229	535
<I/σ(I)>	19.1	2.3
Completeness [%]	95.0	83.2
Redundancy	10.7	6.4
CC(1/2)	1.000	0.856

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.1	293	10% PEG6K, 20 mM sodium citrate pH 5.1, 0.2 M sodium/potassium tartrate