Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c98f80f058dfc458ae4776efc5096464",
"space_group_name": "P 1",
"unit_cell": {
"a": 58.409,
"b": 58.621,
"c": 74.438,
"alpha": 97.110,
"beta": 91.540,
"gamma": 104.841
},
"wavelengths": [0.96862],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.36,1.78],
"number_observations_unique": 88411,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 8.9
},
{
"type": "Completeness",
"value": 97.57
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.78],
"number_observations_unique": 11841,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.619
},
{
"type": "R(meas)",
"value": 1.930
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.314
}
]
}
]
}