Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ebf545c562d0459bc6022f319959eec2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.484,
"b": 61.353,
"c": 65.127,
"alpha": 90.00,
"beta": 92.68,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.45,1.21],
"number_observations": 402353,
"number_observations_unique": 75659,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 87.3
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.23,1.21],
"number_observations": 2097,
"number_observations_unique": 1371,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.814
},
{
"type": "R(meas)",
"value": 1.130
},
{
"type": "R(pim)",
"value": 0.780
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.369
}
]
}
]
}