Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "79a9bb48464ce8a07f456ba11b163e83",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.835,
"b": 61.321,
"c": 65.147,
"alpha": 90.00,
"beta": 92.82,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.52,1.29],
"number_observations": 392098,
"number_observations_unique": 69006,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 10.7
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.31,1.29],
"number_observations": 5651,
"number_observations_unique": 2309,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.244
},
{
"type": "R(meas)",
"value": 1.619
},
{
"type": "R(pim)",
"value": 1.013
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.312
}
]
}
]
}