Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b2fb60aa7e7eb9db7a7664334bd4d9c4",
"space_group_name": "P 21 3",
"unit_cell": {
"a": 178.392,
"b": 178.392,
"c": 178.392,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.07500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.70],
"number_observations_unique": 51489,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "I/SigI",
"value": 10.0
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 3.9
}
]
},
"refln_shells": [
{
"resolution_limits": [2.80,2.70],
"number_observations_unique": 5118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.655
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.6
}
]
},
{
"resolution_limits": [2.91,2.80],
"number_observations_unique": 5171,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.526
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.7
}
]
},
{
"resolution_limits": [3.04,2.91],
"number_observations_unique": 5149,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.403
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 3.7
}
]
},
{
"resolution_limits": [3.20,3.04],
"number_observations_unique": 5149,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.310
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.8
}
]
},
{
"resolution_limits": [3.40,3.20],
"number_observations_unique": 5139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.227
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.9
}
]
},
{
"resolution_limits": [3.66,3.40],
"number_observations_unique": 5177,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.9
}
]
},
{
"resolution_limits": [4.03,3.66],
"number_observations_unique": 5148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 4.0
}
]
},
{
"resolution_limits": [4.60,4.03],
"number_observations_unique": 5171,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 4.1
}
]
},
{
"resolution_limits": [5.81,4.62],
"number_observations_unique": 5123,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 4.1
}
]
},
{
"resolution_limits": [50.00,5.81],
"number_observations_unique": 5144,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "Redundancy",
"value": 4.2
}
]
}
]
}