Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cbb8cdb3059493e977c633871e67446f",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 133.142,
"b": 133.142,
"c": 171.619,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.000,2.500],
"number_observations_unique": 53824,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 6.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.800
}
]
},
"refln_shells": [
{
"resolution_limits": [2.59,2.50],
"number_observations_unique": 5270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.764
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 15.70
}
]
},
{
"resolution_limits": [2.69,2.59],
"number_observations_unique": 5310,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.573
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 16.00
}
]
},
{
"resolution_limits": [2.82,2.69],
"number_observations_unique": 5308,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.418
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 16.00
}
]
},
{
"resolution_limits": [2.96,2.82],
"number_observations_unique": 5315,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.308
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 16.10
}
]
},
{
"resolution_limits": [3.15,2.96],
"number_observations_unique": 5337,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 16.10
}
]
},
{
"resolution_limits": [3.39,3.15],
"number_observations_unique": 5339,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 16.10
}
]
},
{
"resolution_limits": [3.73,3.39],
"number_observations_unique": 5344,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 15.90
}
]
},
{
"resolution_limits": [4.27,3.73],
"number_observations_unique": 5412,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 15.80
}
]
},
{
"resolution_limits": [5.38,4.27],
"number_observations_unique": 5461,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 15.20
}
]
},
{
"resolution_limits": [40.00,5.38],
"number_observations_unique": 5728,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 15.10
}
]
}
]
}