Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "16af8dc49557dbfec9bdb19c0c80edee",
"space_group_name": "I 2 3",
"unit_cell": {
"a": 176.494,
"b": 176.494,
"c": 176.494,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.470,2.480],
"number_observations": 325650,
"number_observations_unique": 32058,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "R(meas)",
"value": 0.156
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.590,2.480],
"number_observations": 31163,
"number_observations_unique": 3428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.992
},
{
"type": "R(meas)",
"value": 1.049
},
{
"type": "R(pim)",
"value": 0.336
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 9.100
},
{
"type": "CC(1/2)",
"value": 0.736
}
]
},
{
"resolution_limits": [39.470,8.960],
"number_observations": 7465,
"number_observations_unique": 736,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}