Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "648a74661dfd74b8315c22feeaead9ec",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.50,
"b": 101.07,
"c": 61.85,
"alpha": 90.00,
"beta": 112.86,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.992,1.40],
"number_observations_unique": 104533,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 6.800
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.400],
"number_observations": 35437,
"number_observations_unique": 5042,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.584
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 94.900
},
{
"type": "Redundancy",
"value": 7.000
}
]
},
{
"resolution_limits": [20.660,7.670],
"number_observations": 4231,
"number_observations_unique": 657,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 35.600
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 6.400
}
]
}
]
}