Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "482174970943cf221a6eaf6811dbc802",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 83.118,
"b": 83.118,
"c": 122.787,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97926],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.380,1.600],
"number_observations": 720144,
"number_observations_unique": 57672,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.640,1.600],
"number_observations": 44233,
"number_observations_unique": 3947,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.264
},
{
"type": "R(meas)",
"value": 2.372
},
{
"type": "R(pim)",
"value": 0.695
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 93.600
},
{
"type": "Redundancy",
"value": 11.200
},
{
"type": "CC(1/2)",
"value": 0.442
}
]
},
{
"resolution_limits": [49.380,7.140],
"number_observations": 8233,
"number_observations_unique": 778,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 45.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}