Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "94303a7c95f52be75f9abbc677146546",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 67.351,
"b": 67.351,
"c": 164.498,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54190],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.580,2.050],
"number_observations": 147596,
"number_observations_unique": 14393,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.261
},
{
"type": "R(meas)",
"value": 0.276
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.050],
"number_observations": 6799,
"number_observations_unique": 1070,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.891
},
{
"type": "R(meas)",
"value": 2.066
},
{
"type": "R(pim)",
"value": 0.814
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.364
}
]
},
{
"resolution_limits": [47.580,8.940],
"number_observations": 2137,
"number_observations_unique": 242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 22.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 8.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}