Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1786f92e7b9c65affa60077eb2fa8289",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.444,
"b": 31.594,
"c": 71.054,
"alpha": 90.00,
"beta": 100.03,
"gamma": 90.00
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,1.80],
"number_observations_unique": 17841,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 17.71
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.80],
"number_observations_unique": 839,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.704
},
{
"type": "R(meas)",
"value": 0.768
},
{
"type": "R(pim)",
"value": 0.301
},
{
"type": "I/SigI",
"value": 1.67
},
{
"type": "CC(1/2)",
"value": 0.737
}
]
}
]
}