Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9567b156cbfdb3dc822a44009a4a98d7",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.894,
"b": 61.452,
"c": 32.673,
"alpha": 90.00,
"beta": 92.83,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.96,1.61],
"number_observations": 126210,
"number_observations_unique": 18734,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.236
},
{
"type": "R(meas)",
"value": 0.256
},
{
"type": "R(pim)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 4.1
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.61],
"number_observations": 5606,
"number_observations_unique": 892,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.80
},
{
"type": "R(meas)",
"value": 9.98
},
{
"type": "R(pim)",
"value": 5.019
},
{
"type": "I/SigI",
"value": 0.1
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.277
}
]
}
]
}