Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e2b37669628ad38b1fe8e45e74514193",
"space_group_name": "P 43 3 2",
"unit_cell": {
"a": 139.18,
"b": 139.18,
"c": 139.18,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.210,1.500],
"number_observations": 5658052,
"number_observations_unique": 73865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 29.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 76.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.540,1.500],
"number_observations": 416213,
"number_observations_unique": 5399,
"quality_factors": [
{
"type": "R(merge)",
"value": 6.300
},
{
"type": "R(meas)",
"value": 6.341
},
{
"type": "R(pim)",
"value": 0.719
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 77.100
},
{
"type": "CC(1/2)",
"value": 0.506
}
]
},
{
"resolution_limits": [49.210,6.710],
"number_observations": 59660,
"number_observations_unique": 988,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "I/SigI",
"value": 91.600
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 60.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}