Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "852383d8dc5842d16fc6ba03d4efae26",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 78.402,
"b": 67.978,
"c": 80.304,
"alpha": 90.000,
"beta": 99.381,
"gamma": 90.000
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.19,2.1],
"number_observations_unique": 48767,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.10],
"number_observations_unique": 4018,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.720
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.893
}
]
}
]
}