Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "64515eca16f8d472fa26815cc7750330",
"space_group_name": "P 1",
"unit_cell": {
"a": 35.800,
"b": 42.476,
"c": 59.734,
"alpha": 74.32,
"beta": 87.40,
"gamma": 86.11
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.520,1.900],
"number_observations": 82664,
"number_observations_unique": 25769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations": 4752,
"number_observations_unique": 1645,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.210
},
{
"type": "R(meas)",
"value": 0.262
},
{
"type": "R(pim)",
"value": 0.154
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.760
}
]
},
{
"resolution_limits": [38.520,9.110],
"number_observations": 837,
"number_observations_unique": 232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 12.200
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.919
}
]
}
]
}