Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1efdb7efc08a08502622e21058f3438c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.308,
"b": 33.710,
"c": 60.150,
"alpha": 90.0,
"beta": 95.7,
"gamma": 90.0
},
"wavelengths": [0.92204],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.700,1.230],
"number_observations": 208481,
"number_observations_unique": 37391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 86.000
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.250,1.230],
"number_observations": 1518,
"number_observations_unique": 779,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.497
},
{
"type": "R(meas)",
"value": 1.982
},
{
"type": "R(pim)",
"value": 1.281
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 36.200
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.333
}
]
},
{
"resolution_limits": [33.700,6.740],
"number_observations": 1768,
"number_observations_unique": 295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 39.200
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}