Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "196668b939d984f132a797b51dd22e7a",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 60.368,
"b": 60.368,
"c": 96.895,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.11587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.27,1.550],
"number_observations_unique": 29769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.61,1.55],
"number_observations_unique": 2923,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.361
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.90
}
]
},
{
"resolution_limits": [1.67,1.61],
"number_observations_unique": 2969,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.321
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 6.20
}
]
},
{
"resolution_limits": [1.75,1.67],
"number_observations_unique": 2911,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.257
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.40
}
]
},
{
"resolution_limits": [1.84,1.75],
"number_observations_unique": 2925,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.50
}
]
},
{
"resolution_limits": [1.95,1.84],
"number_observations_unique": 2950,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.189
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.50
}
]
},
{
"resolution_limits": [2.10,1.95],
"number_observations_unique": 2947,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.40
}
]
},
{
"resolution_limits": [2.32,2.10],
"number_observations_unique": 2984,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 6.20
}
]
},
{
"resolution_limits": [2.65,2.32],
"number_observations_unique": 2980,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.30
}
]
},
{
"resolution_limits": [3.34,2.65],
"number_observations_unique": 3030,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 6.20
}
]
},
{
"resolution_limits": [50.00,3.34],
"number_observations_unique": 3150,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 6.50
}
]
}
]
}