Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "25e45e8f1700b936222e80db1d549f00",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.93,
"b": 81.93,
"c": 135.10,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.020,2.060],
"number_observations": 652516,
"number_observations_unique": 33124,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 20.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.060],
"number_observations": 47066,
"number_observations_unique": 2380,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.336
},
{
"type": "R(meas)",
"value": 1.372
},
{
"type": "R(pim)",
"value": 0.307
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 0.870
}
]
},
{
"resolution_limits": [38.020,9.210],
"number_observations": 6374,
"number_observations_unique": 433,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 51.300
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 14.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}