Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a97dbe52e232487b35330a355303b70a",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 70.700,
"b": 70.700,
"c": 195.747,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [97.650,1.940],
"number_observations": 1007040,
"number_observations_unique": 38030,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.420
},
{
"type": "R(meas)",
"value": 0.429
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 6.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.980,1.940],
"number_observations": 72847,
"number_observations_unique": 2613,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 43.306
},
{
"type": "R(pim)",
"value": 8.138
},
{
"type": "I/SigI",
"value": 0.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.900
},
{
"type": "CC(1/2)",
"value": 0.456
}
]
},
{
"resolution_limits": [97.650,8.870],
"number_observations": 9640,
"number_observations_unique": 505,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 42.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}