Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80fd283268f2148b7b89cfdbcc13f358",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 58.133,
"b": 58.133,
"c": 395.329,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [197.650,1.450],
"number_observations": 1169762,
"number_observations_unique": 72358,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "R(meas)",
"value": 0.147
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 12.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.490,1.450],
"number_observations": 56799,
"number_observations_unique": 5204,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.190
},
{
"type": "R(meas)",
"value": 2.300
},
{
"type": "R(pim)",
"value": 0.695
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.523
}
]
},
{
"resolution_limits": [197.650,6.480],
"number_observations": 15193,
"number_observations_unique": 1063,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 31.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}