Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8607ecd05c9994922da10eef44c0e12b",
"space_group_name": "P 62 2 2",
"unit_cell": {
"a": 133.275,
"b": 133.275,
"c": 288.470,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.260,3.200],
"number_observations": 666066,
"number_observations_unique": 25597,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(meas)",
"value": 0.135
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 27.600
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 26.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [3.280,3.200],
"number_observations": 35919,
"number_observations_unique": 1638,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.174
},
{
"type": "R(meas)",
"value": 1.200
},
{
"type": "R(pim)",
"value": 0.244
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 88.400
},
{
"type": "Redundancy",
"value": 21.900
},
{
"type": "CC(1/2)",
"value": 0.878
}
]
},
{
"resolution_limits": [29.260,14.320],
"number_observations": 6567,
"number_observations_unique": 328,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 90.000
},
{
"type": "Completeness",
"value": 88.600
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}