Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e7557e04cce971aca8f5d1aea486d61e",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 65.095,
"b": 104.370,
"c": 55.489,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.15,1.50],
"number_observations_unique": 30567,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "R(meas)",
"value": 0.179
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 14.6
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.55,1.50],
"number_observations_unique": 2588,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.943
},
{
"type": "R(meas)",
"value": 1.033
},
{
"type": "R(pim)",
"value": 0.416
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.676
}
]
}
]
}