Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7ac8b45c12fa9ffc0fdf54ebc3311c70",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.912,
"b": 57.912,
"c": 396.130,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [198.080,1.490],
"number_observations": 1105616,
"number_observations_unique": 66315,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 16.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.490],
"number_observations": 55997,
"number_observations_unique": 4670,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.045
},
{
"type": "R(meas)",
"value": 2.137
},
{
"type": "R(pim)",
"value": 0.612
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.534
}
]
},
{
"resolution_limits": [198.080,6.660],
"number_observations": 14027,
"number_observations_unique": 987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 48.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}