Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1db7063526d3682973d2e339917bdb5e",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 58.92,
"b": 128.10,
"c": 56.53,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [58.92,2.01],
"number_observations_unique": 29226,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "R(meas)",
"value": 0.142
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 13.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 12.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.08,2.01],
"number_observations_unique": 2876,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.638
},
{
"type": "R(meas)",
"value": 1.704
},
{
"type": "R(pim)",
"value": 0.465
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.565
}
]
},
{
"resolution_limits": [58.92,8.99],
"number_observations_unique": 386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 29.8
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 9.8
}
]
}
]
}