Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "16f912f4b00e5e541b81cb692398a1d2",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 82.328,
"b": 115.744,
"c": 148.029,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.15,1.66],
"number_observations": 1108547,
"number_observations_unique": 83503,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.185
},
{
"type": "R(meas)",
"value": 0.192
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.66],
"number_observations": 43499,
"number_observations_unique": 4089,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.570
},
{
"type": "R(meas)",
"value": 5.856
},
{
"type": "R(pim)",
"value": 1.795
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 10.6
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
}
]
}