Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1be3aaaa39ab9e04876137b47a5c96dd",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 52.241,
"b": 52.241,
"c": 147.870,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.120,1.710],
"number_observations": 277976,
"number_observations_unique": 23105,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 23.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.740,1.710],
"number_observations": 15782,
"number_observations_unique": 1224,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.592
},
{
"type": "I/SigI",
"value": 3.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.924
}
]
},
{
"resolution_limits": [26.120,9.050],
"number_observations": 2017,
"number_observations_unique": 203,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 46.500
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}