Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6ca2df33b4ef7f8057e36d847bb7f94f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.594,
"b": 98.875,
"c": 58.955,
"alpha": 90.00,
"beta": 108.33,
"gamma": 90.00
},
"wavelengths": [0.92010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.560,1.550],
"number_observations": 299258,
"number_observations_unique": 86929,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.550],
"number_observations": 15163,
"number_observations_unique": 4248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.699
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.718
}
]
},
{
"resolution_limits": [46.560,8.490],
"number_observations": 1903,
"number_observations_unique": 554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 24.200
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}