Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "61d0fa493d3b8b7e07c08cbfd8ad703d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.997,
"b": 61.244,
"c": 147.790,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.40,1.20],
"number_observations": 1091338,
"number_observations_unique": 112010,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 13.2
},
{
"type": "Completeness",
"value": 91.3
},
{
"type": "Redundancy",
"value": 9.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations": 4898,
"number_observations_unique": 2819,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.934
},
{
"type": "R(meas)",
"value": 1.231
},
{
"type": "R(pim)",
"value": 0.792
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.299
}
]
}
]
}