Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "76243e15feaf6f5b711d0354d63f1b59",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 78.686,
"b": 165.019,
"c": 80.862,
"alpha": 90.00,
"beta": 109.65,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [82.51,2.20],
"number_observations": 1386043,
"number_observations_unique": 98262,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 14.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.20],
"number_observations_unique": 4890,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.104
},
{
"type": "R(meas)",
"value": 2.182
},
{
"type": "R(pim)",
"value": 0.577
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 14.3
},
{
"type": "CC(1/2)",
"value": 0.791
}
]
}
]
}