Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "597d78605258260a0c3bd9eb6102d7c9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 167.713,
"b": 221.711,
"c": 193.255,
"alpha": 90.00,
"beta": 101.78,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.701,3.890],
"number_observations_unique": 63384,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.008
},
{
"type": "R(meas)",
"value": 1.085
},
{
"type": "R(pim)",
"value": 0.400
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.904
}
]
},
"refln_shells": [
{
"resolution_limits": [3.990,3.890],
"number_observations": 33419,
"number_observations_unique": 4484,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.216
},
{
"type": "R(meas)",
"value": 5.607
},
{
"type": "R(pim)",
"value": 2.049
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.296
}
]
}
]
}