Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5e33e40b270fb498ff0ce4568510d280",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 110.349,
"b": 48.023,
"c": 126.317,
"alpha": 90.00,
"beta": 111.39,
"gamma": 90.00
},
"wavelengths": [0.90000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.9],
"number_observations_unique": 95642,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 7.600
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 9246,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.596
},
{
"type": "Completeness",
"value": 95.80
},
{
"type": "Redundancy",
"value": 4.50
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations_unique": 9269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.451
},
{
"type": "Completeness",
"value": 96.00
},
{
"type": "Redundancy",
"value": 4.50
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations_unique": 9394,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.354
},
{
"type": "Completeness",
"value": 96.30
},
{
"type": "Redundancy",
"value": 4.50
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations_unique": 9381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.278
},
{
"type": "Completeness",
"value": 96.80
},
{
"type": "Redundancy",
"value": 4.60
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations_unique": 9475,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.234
},
{
"type": "Completeness",
"value": 97.30
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations_unique": 9558,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.190
},
{
"type": "Completeness",
"value": 98.60
},
{
"type": "Redundancy",
"value": 4.80
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations_unique": 9691,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations_unique": 9785,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 5.40
}
]
},
{
"resolution_limits": [4.09,3.25],
"number_observations_unique": 9816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 5.40
}
]
},
{
"resolution_limits": [50.00,4.09],
"number_observations_unique": 10027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 5.50
}
]
}
]
}