Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8bab2f4fe95b21e4cd346b9e29952a61",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.78,
"b": 57.44,
"c": 64.83,
"alpha": 90.00,
"beta": 94.56,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.25,1.42],
"number_observations": 357228,
"number_observations_unique": 59894,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.187
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.46,1.42],
"number_observations": 18837,
"number_observations_unique": 4352,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.390
},
{
"type": "R(meas)",
"value": 1.582
},
{
"type": "R(pim)",
"value": 0.742
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.361
}
]
}
]
}