Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c63e47602e3cf9e9dee5aba460093c4f",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 48.906,
"b": 48.906,
"c": 196.343,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.09,2.10],
"number_observations_unique": 16713,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 11.1
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [49.09,8.91],
"number_observations_unique": 288,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 32.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 8.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.16,2.10],
"number_observations_unique": 1321,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.321
},
{
"type": "R(meas)",
"value": 1.511
},
{
"type": "R(pim)",
"value": 0.704
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.687
}
]
}
]
}