Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2937c68c0f5ec59255259916db089a4c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 70.725,
"b": 69.575,
"c": 93.838,
"alpha": 90.00,
"beta": 107.65,
"gamma": 90.00
},
"wavelengths": [0.97740],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.18,3.000],
"number_observations_unique": 17505,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.293
},
{
"type": "R(meas)",
"value": 0.354
},
{
"type": "R(pim)",
"value": 0.197
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.927
}
]
},
"refln_shells": [
{
"resolution_limits": [3.180,3.000],
"number_observations_unique": 2807,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.002
},
{
"type": "R(meas)",
"value": 1.213
},
{
"type": "R(pim)",
"value": 0.675
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.476
}
]
},
{
"resolution_limits": [39.150,9.000],
"number_observations_unique": 674,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}