Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fbc337ada671ffc0ad3c89e38c0de09f",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.791,
"b": 42.791,
"c": 216.933,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.790,2.040],
"number_observations": 316082,
"number_observations_unique": 13817,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.422
},
{
"type": "R(meas)",
"value": 0.431
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.150,2.040],
"number_observations": 47160,
"number_observations_unique": 1949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 15.625
},
{
"type": "R(pim)",
"value": 3.135
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.200
},
{
"type": "CC(1/2)",
"value": 0.456
}
]
},
{
"resolution_limits": [42.790,6.460],
"number_observations": 9707,
"number_observations_unique": 549,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 25.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 17.700
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}