Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5216c3acf23881b7eb3299211ab0f6b7",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 149.248,
"b": 114.986,
"c": 194.050,
"alpha": 90.000,
"beta": 108.034,
"gamma": 90.000
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.7],
"number_observations_unique": 77820,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 14.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.8,2.7],
"number_observations_unique": 5362,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.78
},
{
"type": "R(meas)",
"value": 0.84
},
{
"type": "R(pim)",
"value": 0.32
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.78
}
]
}
]
}