Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a48ec42b454e057a1b134eee50631f09",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 67.059,
"b": 67.059,
"c": 100.713,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.75,1.30],
"number_observations_unique": 46369,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.728
},
{
"type": "R(pim)",
"value": 0.295
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 81.1
},
{
"type": "Redundancy",
"value": 6.5
}
]
},
"refln_shells": [
{
"resolution_limits": [1.32,1.30],
"number_observations_unique": 2044,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.455
},
{
"type": "R(pim)",
"value": 1.984
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Completeness",
"value": 36.6
},
{
"type": "Redundancy",
"value": 2.0
}
]
},
{
"resolution_limits": [20.75,7.12],
"number_observations_unique": 2739,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 8.1
},
{
"type": "Completeness",
"value": 93.1
},
{
"type": "Redundancy",
"value": 7.1
}
]
}
]
}