Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "95726f19c545c6ec83f5b1301945397e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 73.256,
"b": 61.684,
"c": 32.821,
"alpha": 90.00,
"beta": 92.83,
"gamma": 90.00
},
"wavelengths": [0.92209],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.58,2.21],
"number_observations": 21872,
"number_observations_unique": 4698,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 25.2
},
{
"type": "Completeness",
"value": 63.7
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.35,2.21],
"number_observations": 83,
"number_observations_unique": 66,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.152
},
{
"type": "R(pim)",
"value": 0.107
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Redundancy",
"value": 1.3
},
{
"type": "CC(1/2)",
"value": 0.960
}
]
}
]
}