Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "da93b993038dcc4b1d07823ea13304df",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 73.06,
"b": 114.88,
"c": 113.76,
"alpha": 90.000,
"beta": 95.804,
"gamma": 90.000
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.80],
"number_observations_unique": 45520,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.426
},
{
"type": "R(meas)",
"value": 0.504
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.949
}
]
},
"refln_shells": [
{
"resolution_limits": [2.87,2.80],
"number_observations_unique": 3321,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.231
},
{
"type": "R(meas)",
"value": 3.809
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.184
}
]
}
]
}