Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b9ecc7fa758de89268a232dae108b966",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 106.635,
"b": 122.533,
"c": 403.483,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,3.1870],
"number_observations_unique": 88841,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "I/SigI",
"value": 9.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
"refln_shells": [
{
"resolution_limits": [3.310,3.200],
"number_observations_unique": 8740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.557
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 7.500
}
]
},
{
"resolution_limits": [3.450,3.310],
"number_observations_unique": 8767,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.405
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [3.600,3.450],
"number_observations_unique": 8765,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.329
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [3.790,3.600],
"number_observations_unique": 8823,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.265
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [4.030,3.790],
"number_observations_unique": 8776,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.231
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [4.340,4.030],
"number_observations_unique": 8853,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [4.780,4.340],
"number_observations_unique": 8891,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
{
"resolution_limits": [5.470,4.780],
"number_observations_unique": 8920,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.200
}
]
},
{
"resolution_limits": [6.890,5.470],
"number_observations_unique": 9023,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.100
}
]
},
{
"resolution_limits": [50.000,6.890],
"number_observations_unique": 9283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.900
}
]
}
]
}