Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "41e5dfe9204ace9b37d3d9393f55d742",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 329.28,
"b": 83.90,
"c": 133.42,
"alpha": 90.00,
"beta": 111.58,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.47,2.248],
"number_observations_unique": 160811,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 12.1
},
{
"type": "Completeness",
"value": 99.76
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.248],
"number_observations_unique": 7687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.658
},
{
"type": "R(meas)",
"value": 0.895
},
{
"type": "R(pim)",
"value": 0.602
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 96.50
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.562
}
]
}
]
}