Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "37617de6a8c857e5511c920112795026",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 105.924,
"b": 105.924,
"c": 198.073,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.342,2.006],
"number_observations_unique": 45483,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.120
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 14.3
},
{
"type": "Completeness",
"value": 95.6
},
{
"type": "Redundancy",
"value": 9.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.256,2.006],
"number_observations_unique": 2274,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.190
},
{
"type": "R(meas)",
"value": 1.264
},
{
"type": "R(pim)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 78.8
},
{
"type": "Redundancy",
"value": 8.9
},
{
"type": "CC(1/2)",
"value": 0.674
}
]
},
{
"resolution_limits": [72.342,6.708],
"number_observations_unique": 2274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 46.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 8.3
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}