Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "de937ba8eb04c8865d0a54744878d63b",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 78.924,
"b": 78.924,
"c": 233.512,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.39,1.61],
"number_observations_unique": 36745,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 23.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.61],
"number_observations_unique": 1797,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.029
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.496
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.1
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
},
{
"resolution_limits": [44.39,8.82],
"number_observations_unique": 266,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 72.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}