Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "baf0f09da638a53866067715b9631afb",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 58.609,
"b": 86.214,
"c": 46.189,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,1.12],
"number_observations_unique": 84494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 93.4
},
{
"type": "Redundancy",
"value": 5.5
}
]
},
"refln_shells": [
{
"resolution_limits": [1.16,1.12],
"number_observations_unique": 5002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.337
},
{
"type": "Completeness",
"value": 56.1
},
{
"type": "Redundancy",
"value": 1.7
}
]
},
{
"resolution_limits": [1.21,1.16],
"number_observations_unique": 7280,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.309
},
{
"type": "Completeness",
"value": 81.7
},
{
"type": "Redundancy",
"value": 2.3
}
]
},
{
"resolution_limits": [1.26,1.21],
"number_observations_unique": 8669,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.292
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 4.1
}
]
},
{
"resolution_limits": [1.33,1.26],
"number_observations_unique": 8951,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.260
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.1
}
]
},
{
"resolution_limits": [1.41,1.33],
"number_observations_unique": 8979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.3
}
]
},
{
"resolution_limits": [1.52,1.41],
"number_observations_unique": 8962,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.9
}
]
},
{
"resolution_limits": [1.67,1.52],
"number_observations_unique": 9021,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.7
}
]
},
{
"resolution_limits": [1.92,1.67],
"number_observations_unique": 9079,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.4
}
]
},
{
"resolution_limits": [2.41,1.92],
"number_observations_unique": 9093,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.3
}
]
},
{
"resolution_limits": [50.00,2.41],
"number_observations_unique": 9458,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.3
}
]
}
]
}