Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "39fa270b608f3d8254243781e724100a",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.402,
"b": 95.402,
"c": 45.743,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.450,1.350],
"number_observations": 539021,
"number_observations_unique": 45247,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 10.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.370,1.350],
"number_observations": 12511,
"number_observations_unique": 2196,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.112
},
{
"type": "R(meas)",
"value": 2.326
},
{
"type": "R(pim)",
"value": 0.946
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.303
}
]
},
{
"resolution_limits": [67.450,7.390],
"number_observations": 3663,
"number_observations_unique": 305,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 44.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
}
]
}