Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4e4fad632d1ff88a7244280aa5be5e68",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 43.829,
"b": 73.610,
"c": 78.927,
"alpha": 90.00,
"beta": 95.39,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.72,2.58],
"number_observations_unique": 28321,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.158
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 5.2
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [2.72,2.58],
"number_observations": 6753,
"number_observations_unique": 2295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.602
},
{
"type": "R(meas)",
"value": 0.741
},
{
"type": "R(pim)",
"value": 0.427
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.560
}
]
}
]
}