Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cc35691b2e7ddbdc5f04376f9de28652",
"space_group_name": "P 4 2 2",
"unit_cell": {
"a": 88.654,
"b": 88.654,
"c": 92.311,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97942],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.800],
"number_observations_unique": 9570,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.155
},
{
"type": "I/SigI",
"value": 5.700
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 12.900
}
]
},
"refln_shells": [
{
"resolution_limits": [3.02,2.80],
"number_observations_unique": 1774,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.834
},
{
"type": "Completeness",
"value": 95.30
},
{
"type": "Redundancy",
"value": 8.40
}
]
},
{
"resolution_limits": [3.32,3.02],
"number_observations_unique": 1909,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.469
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 13.70
}
]
},
{
"resolution_limits": [3.80,3.32],
"number_observations_unique": 1884,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 14.50
}
]
},
{
"resolution_limits": [4.79,3.80],
"number_observations_unique": 1935,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 14.30
}
]
},
{
"resolution_limits": [50.00,4.79],
"number_observations_unique": 2068,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 13.40
}
]
}
]
}