Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8131d290724893a8a8a23bd3a27f44bc",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.626,
"b": 61.741,
"c": 32.675,
"alpha": 90.0,
"beta": 92.9,
"gamma": 90.0
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.267,1.859],
"number_observations": 31493,
"number_observations_unique": 6639,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(meas)",
"value": 0.146
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 54.3
},
{
"type": "Redundancy",
"value": 4.7
}
]
},
"refln_shells": [
{
"resolution_limits": [2.185,1.859],
"number_observations": 1046,
"number_observations_unique": 332,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.455
},
{
"type": "R(meas)",
"value": 0.519
},
{
"type": "R(pim)",
"value": 0.237
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 3.2
}
]
}
]
}