Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5af6377158663cbc8ed00adda31964de",
"space_group_name": "P 1",
"unit_cell": {
"a": 43.280,
"b": 57.530,
"c": 67.617,
"alpha": 81.060,
"beta": 71.367,
"gamma": 77.140
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.2],
"number_observations_unique": 165512,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 9.6
},
{
"type": "Completeness",
"value": 88.2
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 4743,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.523
},
{
"type": "R(meas)",
"value": 1.688
},
{
"type": "R(pim)",
"value": 0.720
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 51.3
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.390
}
]
}
]
}