Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b1a6d3d1aa92410f889e4d1a9424a414",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 34.260,
"b": 45.634,
"c": 99.031,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.82653],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.52,1.18],
"number_observations_unique": 97218,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.173
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 13.0
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 28.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.20,1.18],
"number_observations_unique": 4566,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.988
},
{
"type": "R(pim)",
"value": 1.029
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 23.7
},
{
"type": "CC(1/2)",
"value": 0.359
}
]
}
]
}