Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0bfc8565806379b91cedf8eb447165ec",
"space_group_name": "P 32",
"unit_cell": {
"a": 82.341,
"b": 82.341,
"c": 168.960,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [71.31,2.928],
"number_observations_unique": 25269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 93.500
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.060,2.928],
"number_observations": 6373,
"number_observations_unique": 1264,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.386
},
{
"type": "R(meas)",
"value": 1.549
},
{
"type": "R(pim)",
"value": 0.689
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 43.900
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.455
}
]
},
{
"resolution_limits": [71.309,8.170],
"number_observations": 6472,
"number_observations_unique": 1263,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 44.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}