Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "803b8248787f9d5c33a85cdc179cc135",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 75.65,
"b": 75.80,
"c": 203.13,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.07227],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.370,2.370],
"number_observations": 312117,
"number_observations_unique": 48272,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.450,2.370],
"number_observations": 29041,
"number_observations_unique": 4662,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.490
},
{
"type": "R(meas)",
"value": 1.628
},
{
"type": "R(pim)",
"value": 0.648
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.527
}
]
},
{
"resolution_limits": [47.370,9.180],
"number_observations": 5720,
"number_observations_unique": 948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 41.700
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}