Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9316efa47019d89ddce8e79c03be3c22",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 53.411,
"b": 53.543,
"c": 161.756,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.000],
"number_observations_unique": 31381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 28.725
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"number_observations_unique": 2808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.331
},
{
"type": "Completeness",
"value": 88.70
},
{
"type": "Redundancy",
"value": 4.60
}
]
},
{
"resolution_limits": [2.15,2.07],
"number_observations_unique": 3070,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.259
},
{
"type": "Completeness",
"value": 96.60
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [2.25,2.15],
"number_observations_unique": 3065,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.203
},
{
"type": "Completeness",
"value": 97.10
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [2.37,2.25],
"number_observations_unique": 3083,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.176
},
{
"type": "Completeness",
"value": 97.40
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [2.52,2.37],
"number_observations_unique": 3140,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "Completeness",
"value": 97.90
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [2.71,2.52],
"number_observations_unique": 3141,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "Completeness",
"value": 98.30
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [2.99,2.71],
"number_observations_unique": 3177,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "Completeness",
"value": 98.70
},
{
"type": "Redundancy",
"value": 4.70
}
]
},
{
"resolution_limits": [3.42,2.99],
"number_observations_unique": 3196,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "Completeness",
"value": 99.00
},
{
"type": "Redundancy",
"value": 4.60
}
]
},
{
"resolution_limits": [4.31,3.42],
"number_observations_unique": 3250,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 4.60
}
]
},
{
"resolution_limits": [50.00,4.31],
"number_observations_unique": 3451,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 4.30
}
]
}
]
}