Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1765288158f7cb024b99ee185448c901",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 67.190,
"b": 67.190,
"c": 165.735,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.620,1.390],
"number_observations": 858182,
"number_observations_unique": 45535,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.130
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.440,1.390],
"number_observations": 84534,
"number_observations_unique": 4374,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.373
},
{
"type": "R(meas)",
"value": 2.437
},
{
"type": "R(pim)",
"value": 0.550
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 0.558
}
]
},
{
"resolution_limits": [47.620,5.380],
"number_observations": 15454,
"number_observations_unique": 960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 43.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 16.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}