Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "d01065735b111b20e1fe57d4512974b4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.503,
"b": 82.073,
"c": 38.476,
"alpha": 90.000,
"beta": 98.306,
"gamma": 90.000
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.7,1.69],
"number_observations_unique": 33727,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05328
},
{
"type": "R(meas)",
"value": 0.06837
},
{
"type": "R(pim)",
"value": 0.04227
},
{
"type": "I/SigI",
"value": 4.82
},
{
"type": "Completeness",
"value": 97.47
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.74,1.69],
"number_observations_unique": 5522,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.648
},
{
"type": "R(meas)",
"value": 2.115
},
{
"type": "R(pim)",
"value": 1.309
},
{
"type": "I/SigI",
"value": 0.48
},
{
"type": "CC(1/2)",
"value": 0.408
}
]
}
]
}