Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "84c6e369a41dd2141edd357272af9285",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.421,
"b": 95.421,
"c": 45.735,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.240,1.340],
"number_observations": 545867,
"number_observations_unique": 46288,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 20.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.360,1.340],
"number_observations": 11964,
"number_observations_unique": 2252,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.472
},
{
"type": "R(meas)",
"value": 1.649
},
{
"type": "R(pim)",
"value": 0.716
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.307
}
]
},
{
"resolution_limits": [41.240,7.340],
"number_observations": 3700,
"number_observations_unique": 306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 92.500
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}