Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "92f3341046133c3e61633b79467abda9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.332,
"b": 53.267,
"c": 44.382,
"alpha": 90.00,
"beta": 103.03,
"gamma": 90.00
},
"wavelengths": [0.91259],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.21,1.61],
"number_observations": 92807,
"number_observations_unique": 32544,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 5.6
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.61],
"number_observations": 3719,
"number_observations_unique": 1584,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.150
},
{
"type": "R(meas)",
"value": 1.451
},
{
"type": "R(pim)",
"value": 0.873
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.318
}
]
}
]
}