Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5ee641a70e9f44a09ac7c3fe57e681e1",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 36.718,
"b": 36.718,
"c": 142.997,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.72,1.63],
"number_observations": 149555,
"number_observations_unique": 13105,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 11.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.66,1.63],
"number_observations": 7777,
"number_observations_unique": 636,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.170
},
{
"type": "R(meas)",
"value": 3.307
},
{
"type": "R(pim)",
"value": 0.934
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 12.2
},
{
"type": "CC(1/2)",
"value": 0.261
}
]
}
]
}