Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a20a9ed52ace8119e54abedb48dde122",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 69.873,
"b": 71.696,
"c": 120.736,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.90020],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.646,1.205],
"number_observations_unique": 149092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 90.0
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [61.646,3.454],
"number_observations_unique": 7455,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 58.4
},
{
"type": "Completeness",
"value": 88.7
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.289,1.205],
"number_observations_unique": 7457,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.894
},
{
"type": "R(meas)",
"value": 1.109
},
{
"type": "R(pim)",
"value": 0.648
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 47.1
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.565
}
]
}
]
}