Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "560f2fe989aa1b3bf7e479da1b2242ca",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.912,
"b": 70.701,
"c": 72.135,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.48000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.540,2.300],
"number_observations": 174536,
"number_observations_unique": 14223,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.187
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 13.200
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations": 14704,
"number_observations_unique": 1249,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.036
},
{
"type": "R(meas)",
"value": 1.083
},
{
"type": "R(pim)",
"value": 0.311
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 91.400
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.778
}
]
},
{
"resolution_limits": [46.540,8.920],
"number_observations": 3010,
"number_observations_unique": 296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 37.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}