Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "af64b721608ef2949b1b0a8e682e4ecd",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 62.033,
"b": 66.772,
"c": 120.502,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54184],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.250,1.750],
"number_observations": 289696,
"number_observations_unique": 25252,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 20.800
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 11.500
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
"refln_shells": [
{
"resolution_limits": [1.780,1.750],
"number_observations": 5480,
"number_observations_unique": 1143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.848
},
{
"type": "R(meas)",
"value": 0.952
},
{
"type": "R(pim)",
"value": 0.418
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 84.800
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.609
}
]
},
{
"resolution_limits": [60.250,9.090],
"number_observations": 1212,
"number_observations_unique": 216,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 39.500
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}