Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3331a973928c1b6916d25f65eb26064e",
"space_group_name": "P 2 2 21",
"unit_cell": {
"a": 119.084,
"b": 174.100,
"c": 180.902,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.570,4.000],
"number_observations_unique": 30328,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.151
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 94.000
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [4.220,4.000],
"number_observations_unique": 4390,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.671
},
{
"type": "R(meas)",
"value": 1.808
},
{
"type": "R(pim)",
"value": 0.667
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.470
}
]
},
{
"resolution_limits": [49.570,12.650],
"number_observations_unique": 997,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Completeness",
"value": 89.100
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}