Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f97617f3fc2c5177c379f047724d0b50",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.208,
"b": 84.949,
"c": 90.070,
"alpha": 70.84,
"beta": 74.08,
"gamma": 86.93
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.740,2.400],
"number_observations_unique": 48143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.172
},
{
"type": "R(pim)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 5.900
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [2.530,2.400],
"number_observations_unique": 7346,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.376
},
{
"type": "R(meas)",
"value": 0.539
},
{
"type": "R(pim)",
"value": 0.307
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.845
}
]
},
{
"resolution_limits": [49.740,7.590],
"number_observations_unique": 1599,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}