Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6911c459551afa7afcad3abe8afe67be",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 68.044,
"b": 68.115,
"c": 138.325,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [138.320,1.760],
"number_observations": 437214,
"number_observations_unique": 64406,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "R(meas)",
"value": 0.178
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.959
}
]
},
"refln_shells": [
{
"resolution_limits": [1.800,1.760],
"number_observations": 23846,
"number_observations_unique": 3552,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.470
},
{
"type": "R(meas)",
"value": 3.760
},
{
"type": "R(pim)",
"value": 1.440
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.400
}
]
},
{
"resolution_limits": [138.320,8.980],
"number_observations": 3236,
"number_observations_unique": 586,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 47.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.771
}
]
}
]
}