Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "0b89a02020a23cb5a775d7f71ee35347",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.446,
"b": 83.773,
"c": 58.984,
"alpha": 90.00,
"beta": 108.17,
"gamma": 90.00
},
"wavelengths": [0.92202],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [83.770,1.500],
"number_observations": 419221,
"number_observations_unique": 69737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 9.100
},
{
"type": "Completeness",
"value": 85.200
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 5007,
"number_observations_unique": 1496,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.855
},
{
"type": "R(meas)",
"value": 2.207
},
{
"type": "R(pim)",
"value": 1.179
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 35.900
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.338
}
]
},
{
"resolution_limits": [83.770,8.080],
"number_observations": 3537,
"number_observations_unique": 555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 38.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}