Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7aabb13997d9b3ba8155c27158e0f9d9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.112,
"b": 41.459,
"c": 71.888,
"alpha": 90.000,
"beta": 104.135,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.87,1.80],
"number_observations_unique": 22560,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 22.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 17.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 1330,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.152
},
{
"type": "R(meas)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 18.4
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}