Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "59e37e7f34e3b2f816320c4963002385",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 33.957,
"b": 118.525,
"c": 167.210,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.44,1.75],
"number_observations_unique": 69593,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.402
},
{
"type": "R(meas)",
"value": 0.434
},
{
"type": "R(pim)",
"value": 0.165
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.0
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [50.44,9.09],
"number_observations_unique": 6845,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 11.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.78,1.75],
"number_observations_unique": 6845,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.210
},
{
"type": "R(meas)",
"value": 5.662
},
{
"type": "R(pim)",
"value": 2.205
},
{
"type": "Redundancy",
"value": 12.6
},
{
"type": "CC(1/2)",
"value": 0.199
}
]
}
]
}