Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "100223917fcc620eba3276f0ff6731e5",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 48.04,
"b": 89.89,
"c": 97.33,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.850,1.920],
"number_observations": 206841,
"number_observations_unique": 32987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "R(meas)",
"value": 0.184
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 6.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.970,1.920],
"number_observations": 13733,
"number_observations_unique": 2163,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.528
},
{
"type": "R(meas)",
"value": 1.666
},
{
"type": "R(pim)",
"value": 0.658
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.207
}
]
},
{
"resolution_limits": [38.850,9.010],
"number_observations": 2025,
"number_observations_unique": 384,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 16.400
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}