Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ed601a02c84ef0ebb5b97e32966b235b",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 77.808,
"b": 77.808,
"c": 84.899,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.9],
"number_observations_unique": 21317,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.113
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 22.84
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.93,1.90],
"number_observations_unique": 1043,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.915
},
{
"type": "R(meas)",
"value": 0.958
},
{
"type": "R(pim)",
"value": 0.276
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.4
},
{
"type": "CC(1/2)",
"value": 0.850
}
]
}
]
}