Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f279b39da8d6b99c24ec6ee52c117e6f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 75.727,
"b": 69.484,
"c": 78.680,
"alpha": 90.00,
"beta": 100.89,
"gamma": 90.00
},
"wavelengths": [1.07230],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.473,2.000],
"number_observations_unique": 52114,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "R(meas)",
"value": 0.175
},
{
"type": "R(pim)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 7.000
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations_unique": 3142,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.596
},
{
"type": "R(meas)",
"value": 0.767
},
{
"type": "R(pim)",
"value": 0.475
},
{
"type": "Completeness",
"value": 75.400
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.554
}
]
},
{
"resolution_limits": [74.473,8.720],
"number_observations_unique": 695,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
}
]
}