Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "033126233ee45c1f094cd74eac7d190b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.12,
"b": 137.23,
"c": 161.34,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [104.530,2.000],
"number_observations": 387434,
"number_observations_unique": 91063,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.178
},
{
"type": "R(pim)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.030,2.000],
"number_observations": 18805,
"number_observations_unique": 4389,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.387
},
{
"type": "R(meas)",
"value": 1.569
},
{
"type": "R(pim)",
"value": 0.727
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.757
}
]
},
{
"resolution_limits": [104.530,10.950],
"number_observations": 2291,
"number_observations_unique": 663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 8.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}