Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "95f3f24c41cc2401112948488b918431",
"space_group_name": "P 1",
"unit_cell": {
"a": 39.861,
"b": 45.628,
"c": 60.359,
"alpha": 84.76,
"beta": 83.22,
"gamma": 78.60
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.790,1.600],
"number_observations": 225293,
"number_observations_unique": 53868,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 15.800
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 11260,
"number_observations_unique": 2631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.511
},
{
"type": "R(pim)",
"value": 0.278
},
{
"type": "I/SigI",
"value": 4.600
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.929
}
]
},
{
"resolution_limits": [59.790,8.760],
"number_observations": 1417,
"number_observations_unique": 328,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 39.000
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}