Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9b32191f77b9df594e2d8b1657b8120f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 61.366,
"b": 26.929,
"c": 63.532,
"alpha": 90.00,
"beta": 96.38,
"gamma": 90.00
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.57,2.54],
"number_observations_unique": 3530,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 6.0
},
{
"type": "Completeness",
"value": 95.34
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.631,2.54],
"number_observations_unique": 319,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 87.28
},
{
"type": "CC(1/2)",
"value": 0.773
}
]
}
]
}