Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "98524f6f3899eb3901d739e18cf04b76",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.54,
"b": 32.64,
"c": 72.17,
"alpha": 90.00,
"beta": 90.44,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.42,1.55],
"number_observations_unique": 34001,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 25.4
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 12.1
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.61,1.55],
"number_observations_unique": 2948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.017
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 87.1
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.823
}
]
}
]
}