Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "1a881b0a0887eb2f06f0d013af3b974e",
"space_group_name": "P 31",
"unit_cell": {
"a": 106.554,
"b": 106.554,
"c": 46.383,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.28,2.48],
"number_observations_unique": 20727,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.150
},
{
"type": "R(meas)",
"value": 0.154
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 13.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 16.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.497,2.489],
"number_observations_unique": 213,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.236
},
{
"type": "R(meas)",
"value": 1.426
},
{
"type": "R(pim)",
"value": 0.701
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.379
}
]
}
]
}