Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5adee7979522f81fa1368978187841f8",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.866,
"b": 104.406,
"c": 153.787,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.450,1.600],
"number_observations": 1591319,
"number_observations_unique": 117277,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 19.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 79062,
"number_observations_unique": 5715,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.970
},
{
"type": "R(meas)",
"value": 2.045
},
{
"type": "R(pim)",
"value": 0.545
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.684
}
]
},
{
"resolution_limits": [38.450,8.760],
"number_observations": 10318,
"number_observations_unique": 837,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.020
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "I/SigI",
"value": 88.600
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}