Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "db8193dd444daeb736f2c6f8a80a820e",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 72.393,
"b": 121.583,
"c": 166.372,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [98.164,1.708],
"number_observations_unique": 159024,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 17.44
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.71],
"number_observations_unique": 25291,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.863
},
{
"type": "R(meas)",
"value": 0.942
},
{
"type": "I/SigI",
"value": 2.37
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.81
}
]
}
]
}