Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2b177731f0848b449f34362abcddd5b8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 47.573,
"b": 32.454,
"c": 79.634,
"alpha": 90.00,
"beta": 89.97,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.40],
"number_observations_unique": 51025,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 24.878
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations_unique": 2526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.723
},
{
"type": "R(meas)",
"value": 0.971
},
{
"type": "R(pim)",
"value": 0.442
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.708
}
]
}
]
}