Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e3bb1779152aaa3bffde9b7d4fde963b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 130.69,
"b": 44.31,
"c": 30.81,
"alpha": 90.00,
"beta": 92.94,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.630,1.360],
"number_observations": 271636,
"number_observations_unique": 37738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.400,1.360],
"number_observations": 18425,
"number_observations_unique": 2803,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.527
},
{
"type": "R(meas)",
"value": 1.662
},
{
"type": "R(pim)",
"value": 0.641
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.557
}
]
},
{
"resolution_limits": [32.630,6.080],
"number_observations": 2972,
"number_observations_unique": 451,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 51.000
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}