Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0edde6fb77cc644dbab334eadbef74bf",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.671,
"b": 95.671,
"c": 45.886,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.640,1.320],
"number_observations": 559151,
"number_observations_unique": 46840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 14.800
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 11.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.340,1.320],
"number_observations": 10619,
"number_observations_unique": 1660,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.810
},
{
"type": "R(meas)",
"value": 1.972
},
{
"type": "R(pim)",
"value": 0.752
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 70.500
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.317
}
]
},
{
"resolution_limits": [67.640,7.230],
"number_observations": 4041,
"number_observations_unique": 328,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 83.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}