Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "029450d27b2faf77d631afaefadb5a3a",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 80.649,
"b": 106.347,
"c": 117.232,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97960,1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.4,1.799],
"number_observations_unique": 46824,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 36
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.2
}
]
},
"refln_shells": [
{
"resolution_limits": [1.91,1.799],
"number_observations_unique": 7745,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.580
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 5.3
}
]
},
{
"resolution_limits": [2.06,1.91],
"number_observations_unique": 7718,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.270
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.4
}
]
},
{
"resolution_limits": [2.27,2.06],
"number_observations_unique": 7766,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 5.4
}
]
},
{
"resolution_limits": [2.60,2.27],
"number_observations_unique": 7821,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.3
}
]
},
{
"resolution_limits": [3.27,2.60],
"number_observations_unique": 7825,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.3
}
]
},
{
"resolution_limits": [50.0,3.27],
"number_observations_unique": 7737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "Completeness",
"value": 95.4
},
{
"type": "Redundancy",
"value": 5.2
}
]
}
]
}