Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "059b1a9964b66ec664ac7dab75fe28f7",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 36.577,
"b": 36.577,
"c": 141.800,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.58,1.82],
"number_observations": 106400,
"number_observations_unique": 9376,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "R(meas)",
"value": 0.173
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 11.3
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.85,1.82],
"number_observations": 4528,
"number_observations_unique": 447,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.216
},
{
"type": "R(meas)",
"value": 4.449
},
{
"type": "R(pim)",
"value": 1.384
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 10.1
},
{
"type": "CC(1/2)",
"value": 0.180
}
]
}
]
}