Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fbc19faf6260ea9e4169860f57884d97",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.276,
"b": 71.276,
"c": 196.190,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [71.260,1.920],
"number_observations": 1055609,
"number_observations_unique": 39522,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.412
},
{
"type": "R(meas)",
"value": 0.420
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 6.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 26.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.970,1.920],
"number_observations": 73062,
"number_observations_unique": 2586,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.302
},
{
"type": "R(meas)",
"value": 9.470
},
{
"type": "R(pim)",
"value": 1.761
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 28.300
},
{
"type": "CC(1/2)",
"value": 0.453
}
]
},
{
"resolution_limits": [71.260,9.010],
"number_observations": 9303,
"number_observations_unique": 488,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 37.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}