Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "d91819198cd73ae6cec33186e14f1033",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.01,
"b": 82.01,
"c": 135.07,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.240,2.130],
"number_observations": 585749,
"number_observations_unique": 30031,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 17.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.190,2.130],
"number_observations": 43915,
"number_observations_unique": 2196,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.597
},
{
"type": "R(meas)",
"value": 1.638
},
{
"type": "R(pim)",
"value": 0.365
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.823
}
]
},
{
"resolution_limits": [39.240,9.530],
"number_observations": 5658,
"number_observations_unique": 393,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 47.400
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 14.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}