Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "89e5c193bd56cdbe35bf1ccb2dc63303",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 82.260,
"b": 116.109,
"c": 148.109,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.38,1.66],
"number_observations": 1114397,
"number_observations_unique": 83704,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.170
},
{
"type": "R(meas)",
"value": 0.177
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.66],
"number_observations": 43777,
"number_observations_unique": 4104,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.705
},
{
"type": "R(meas)",
"value": 4.943
},
{
"type": "R(pim)",
"value": 1.508
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 10.7
},
{
"type": "CC(1/2)",
"value": 0.306
}
]
}
]
}