Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "07349f665308c132eaccf6793d3674b2",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 88.980,
"b": 61.900,
"c": 111.322,
"alpha": 90.000,
"beta": 104.983,
"gamma": 90.000
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.83,1.95],
"number_observations_unique": 42630,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.09
},
{
"type": "R(meas)",
"value": 0.1
},
{
"type": "R(pim)",
"value": 0.04
},
{
"type": "I/SigI",
"value": 16.6
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.95],
"number_observations_unique": 2952,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.80
},
{
"type": "R(meas)",
"value": 0.93
},
{
"type": "R(pim)",
"value": 0.45
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "CC(1/2)",
"value": 0.59
}
]
}
]
}