Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c4f20c8057a0eeb498bcbccecef96117",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.70,
"b": 99.03,
"c": 103.46,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97624],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.65,2.03],
"number_observations": 619164,
"number_observations_unique": 45704,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.256
},
{
"type": "R(meas)",
"value": 0.266
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.08,2.03],
"number_observations": 43944,
"number_observations_unique": 3295,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.594
},
{
"type": "R(meas)",
"value": 4.776
},
{
"type": "R(pim)",
"value": 1.301
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.467
}
]
}
]
}