Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "20702b92f89a0481342ac698bdd7671b",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.804,
"b": 88.804,
"c": 39.531,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,1.020],
"number_observations": 1011450,
"number_observations_unique": 156532,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 16.100
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.040,1.020],
"number_observations": 45045,
"number_observations_unique": 7562,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.135
},
{
"type": "R(meas)",
"value": 1.245
},
{
"type": "R(pim)",
"value": 0.501
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.780
}
]
},
{
"resolution_limits": [44.400,5.590],
"number_observations": 7178,
"number_observations_unique": 1040,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 55.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}