Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "67e17b022533a10f5d1b1adb0102fd8a",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 109.965,
"b": 109.965,
"c": 90.135,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.25240],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.46,2.100],
"number_observations_unique": 12387,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(meas)",
"value": 0.113
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 27.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 15246,
"number_observations_unique": 999,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.145
},
{
"type": "R(meas)",
"value": 2.219
},
{
"type": "R(pim)",
"value": 0.558
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.300
},
{
"type": "CC(1/2)",
"value": 0.508
}
]
},
{
"resolution_limits": [42.100,8.910],
"number_observations": 3484,
"number_observations_unique": 182,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 107.100
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}