Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7841dc02d532edd8785e1551190118f3",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 103.44,
"b": 103.44,
"c": 49.95,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.260,2.300],
"number_observations": 311398,
"number_observations_unique": 12429,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 27.000
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 25.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.360,2.300],
"number_observations": 21897,
"number_observations_unique": 884,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.171
},
{
"type": "R(meas)",
"value": 1.195
},
{
"type": "R(pim)",
"value": 0.237
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 24.800
},
{
"type": "CC(1/2)",
"value": 0.900
}
]
},
{
"resolution_limits": [46.260,10.290],
"number_observations": 3366,
"number_observations_unique": 177,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 55.200
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 19.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}