Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "242df2cca8a2e4a0f09f650aeeb125fc",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.094,
"b": 88.094,
"c": 39.146,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91188],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.120,1.030],
"number_observations": 759181,
"number_observations_unique": 145512,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.050,1.030],
"number_observations": 10718,
"number_observations_unique": 5779,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.484
},
{
"type": "R(meas)",
"value": 1.959
},
{
"type": "R(pim)",
"value": 1.259
},
{
"type": "I/SigI",
"value": 0.200
},
{
"type": "Completeness",
"value": 76.700
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.317
}
]
},
{
"resolution_limits": [88.120,5.550],
"number_observations": 6750,
"number_observations_unique": 1040,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 36.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.963
}
]
}
]
}