Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7d951e76634cbcd05b5033d2fe48be94",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.821,
"b": 57.821,
"c": 396.079,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [396.070,1.580],
"number_observations": 977516,
"number_observations_unique": 55931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "R(meas)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 13.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.620,1.580],
"number_observations": 56577,
"number_observations_unique": 4022,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.439
},
{
"type": "R(meas)",
"value": 2.532
},
{
"type": "R(pim)",
"value": 0.674
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.100
},
{
"type": "CC(1/2)",
"value": 0.568
}
]
},
{
"resolution_limits": [396.070,7.070],
"number_observations": 11975,
"number_observations_unique": 848,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 49.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}