Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "241618247c68c4fc12838eece304310a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.859,
"b": 27.516,
"c": 56.423,
"alpha": 90.00,
"beta": 99.81,
"gamma": 90.00
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.600,1.180],
"number_observations": 172835,
"number_observations_unique": 33601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(meas)",
"value": 0.122
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 9.500
},
{
"type": "Completeness",
"value": 81.500
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [1.200,1.180],
"number_observations": 433,
"number_observations_unique": 369,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.236
},
{
"type": "R(meas)",
"value": 1.742
},
{
"type": "R(pim)",
"value": 1.227
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 18.000
},
{
"type": "Redundancy",
"value": 1.200
},
{
"type": "CC(1/2)",
"value": 0.179
}
]
},
{
"resolution_limits": [55.600,6.460],
"number_observations": 1685,
"number_observations_unique": 288,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 32.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
}
]
}