Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e9b54d63c8e78b90191c846f3447802b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.495,
"b": 130.516,
"c": 90.170,
"alpha": 90.00,
"beta": 104.41,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [130.490,2.250],
"number_observations_unique": 47317,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.370,2.250],
"number_observations_unique": 6830,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.409
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
},
{
"resolution_limits": [130.490,7.120],
"number_observations_unique": 1558,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}